0 B8R0.23 C=C(CC(=O)Cl)C(=O)Cl CNP0326877.0 [0,0,0,0,0,0|3,0,1]=4 1 B8R0.23 C=C(CC(=O)N)C(=O)N CNP0145469.0 [0,0,0,0,0,0|3,0,1]=4 2 B8R0.23 C=C(CC(=O)O)C(=O)O CNP0269442.0 [0,0,0,0,0,0|1,0,1]=2 3 B8R0.23 C=C(Cl)C[C@H](N)C(=O)O CNP0106223.1 [0,0,0,0,0,0|3,0,0]=3 4 B8R0.23 C=C(Cl)[C@H](O)CC(=O)N CNP0072044.1 [0,0,0,0,0,0|3,0,0]=3 5 B8R0.23 CC(=CC(=O)N)C(=O)O CNP0166908.0 [0,0,0,0,0,0|2,0,2]=4 6 B8R0.23 CC(=CC(=O)O)C(=O)O CNP0236669.0 [0,0,0,0,0,0|1,0,2]=3 7 B8R0.23 CC(=O)C(O)CC(C)C CNP0003259.0 [0,0,0,0,0,0|3,0,1]=4 8 B8R0.23 CC(=O)CC(=O)C(=O)O CNP0082978.0 [0,0,0,0,0,0|1,0,2]=3 9 B8R0.23 CC(=O)CC(N)C(=O)O CNP0533011.0 [0,0,0,0,0,0|2,0,0]=2 10 B8R0.23 CC(=O)C[C@@H](O)C(=O)C CNP0180429.1 [0,0,0,0,0,0|2,0,0]=2 11 B8R0.23 CC(=O)C[C@@H](O)C(=O)O CNP0195071.1 [0,0,0,0,0,0|1,0,0]=1 12 B8R0.23 CC(=O)C[C@H](O)C(=O)O CNP0195071.2 [0,0,0,0,0,0|1,0,0]=1 13 B8R0.23 CC(=O)N[C@@H](C)C(=O)O CNP0136136.1 [0,0,0,0,0,0|3,0,0]=3 14 B8R0.23 CC(=O)OC(C)C(=O)Cl CNP0312300.0 [0,0,0,0,0,0|4,0,0]=4 15 B8R0.23 CC(=O)O[C@H](C)C(=O)C CNP0270762.1 [0,0,0,0,0,0|4,0,0]=4 16 B8R0.23 CC(=O)O[C@H](C)C(=O)O CNP0159286.1 [0,0,0,0,0,0|3,0,0]=3 17 B8R0.23 CC(=O)[C@@H](C)CC(=O)O CNP0299581.1 [0,0,0,0,0,0|2,0,0]=2 18 B8R0.23 CC(C)C[C@@H](N)C(=O)O CNP0201141.2 [0,0,0,0,0,0|3,0,1]=4 19 B8R0.23 CC(C)C[C@@H](O)C(=O)O CNP0270190.1 [0,0,0,0,0,0|2,0,1]=3 20 B8R0.23 CC(C)C[C@H](N)C(=O)O CNP0201141.1 [0,0,0,0,0,0|3,0,1]=4 21 B8R0.23 CC(C)C[C@H](O)C(=O)O CNP0270190.2 [0,0,0,0,0,0|2,0,1]=3 22 B8R0.23 CC(C)[C@@H](N)CC(=O)O CNP0294752.1 [0,0,0,0,0,0|3,0,1]=4 23 B8R0.23 CC(C)[C@H](O)CC(=O)O CNP0314965.1 [0,0,0,0,0,0|2,0,1]=3 24 B8R0.23 CC(NC(=N)N)C(=O)O CNP0082989.0 [0,0,0,0,0,0|4,0,0]=4 25 B8R0.23 CC(O)C(N)CC(=O)O CNP0415810.0 [0,0,0,0,0,0|2,0,1]=3 26 B8R0.23 CC(O)CC(=O)C(=O)O CNP0082912.0 [0,0,0,0,0,0|1,0,3]=4 27 B8R0.23 CN(C)C[C@H](N)C(=O)O CNP0374568.1 [0,0,0,0,0,0|4,0,0]=4 28 B8R0.23 CN(CC(=O)O)C(=N)N CNP0156562.0 [0,0,0,0,0,0|4,0,0]=4 29 B8R0.23 CN(CC(=O)O)C(=O)N CNP0548599.0 [0,0,0,0,0,0|3,0,0]=3 30 B8R0.23 CN(CC(=O)O)C(=S)S CNP0495623.0 [0,0,0,0,0,0|2,2,0]=4 31 B8R0.23 C[C@@H](CC(=O)O)C(=O)O CNP0294195.2 [0,0,0,0,0,0|1,0,0]=1 32 B8R0.23 C[C@@H](NC(=O)N)C(=O)O CNP0369812.2 [0,0,0,0,0,0|3,0,0]=3 33 B8R0.23 C[C@@H](O)C[C@@H](N)C(=O)O CNP0191849.1 [0,0,0,0,0,0|2,0,1]=3 34 B8R0.23 C[C@@H](O)C[C@H](N)C(=O)O CNP0191849.2 [0,0,0,0,0,0|2,0,1]=3 35 B8R0.23 C[C@H](CC(=O)O)C(=O)O CNP0294195.1 [0,0,0,0,0,0|1,0,0]=1 36 B8R0.23 C[C@H](Cl)C[C@H](N)C(=O)O CNP0194801.1 [0,0,0,0,0,0|3,0,1]=4 37 B8R0.23 C[C@H](N)C[C@@H](N)C(=O)O CNP0252327.1 [0,0,0,0,0,0|3,0,1]=4 38 B8R0.23 C[C@H](NC(=O)N)C(=O)O CNP0369812.1 [0,0,0,0,0,0|3,0,0]=3 39 B8R0.23 C[C@H](O)C[C@H](N)C(=O)O CNP0191849.3 [0,0,0,0,0,0|2,0,1]=3 40 B8R0.23 C[S+]([O-])C(O)CC(=O)O CNP0600737.0 [0,0,0,0,0,0|2,0,1]=3 41 B8R0.23 C[S+]([O-])C[C@@H](N)C(=O)O CNP0580567.3 [0,0,0,0,0,0|3,0,1]=4 42 B8R0.23 C[S+]([O-])C[C@H](N)C(=O)O CNP0580567.2 [0,0,0,0,0,0|3,0,1]=4 43 B8R0.23 C[S@+]([O-])C[C@@H](N)C(=O)O CNP0580567.4 [0,0,0,0,0,0|3,0,1]=4 44 B8R0.23 C[S@+]([O-])C[C@H](N)C(=O)O CNP0580567.1 [0,0,0,0,0,0|3,0,1]=4 45 B8R0.23 C[S@H+]([O-])C[C@@H](N)C(=O)O CNP0585919.2 [0,0,0,0,0,0|3,0,1]=4 46 B8R0.23 C[S@H+]([O-])C[C@H](N)C(=O)O CNP0585919.1 [0,0,0,0,0,0|3,0,1]=4 47 B8R0.23 C[SeH](=O)C[C@H](N)C(=O)O CNP0480445.1 [0,0,0,0,0,0|3,0,0]=3 48 B8R0.23 C[Se](=O)C[C@H](N)C(=O)O CNP0218473.1 [0,0,0,0,0,0|3,0,0]=3 49 B8R0.23 N=C(CC(=O)O)C(=O)O CNP0417649.0 [0,0,0,0,0,0|1,0,1]=2 50 B8R0.23 NC(=O)C[C@@H](N)C(=O)O CNP0267849.2 [0,0,0,0,0,0|2,0,0]=2 51 B8R0.23 NC(=O)C[C@H](N)C(=O)O CNP0267849.1 [0,0,0,0,0,0|2,0,0]=2 52 B8R0.23 NC(=O)NC(=O)C(=O)O CNP0197878.0 [0,0,0,0,0,0|2,0,2]=4 53 B8R0.23 NC(=O)N[C@@H](O)C(=O)O CNP0085588.2 [0,0,0,0,0,0|2,0,0]=2 54 B8R0.23 NC(=O)N[C@H](N)C(=O)O CNP0313342.1 [0,0,0,0,0,0|3,0,0]=3 55 B8R0.23 NC(=O)N[C@H](O)C(=O)O CNP0085588.1 [0,0,0,0,0,0|2,0,0]=2 56 B8R0.23 NC(=O)[C@@H](N)CC(=O)O CNP0177552.1 [0,0,0,0,0,0|2,0,0]=2 57 B8R0.23 NC(CC(=O)O)C(=O)[O-] CNP0542511.0 [0,0,0,0,0,0|1,0,1]=2 58 B8R0.23 NC(CC(=O)[O-])C(=O)O CNP0606657.0 [0,0,0,0,0,0|1,0,1]=2 59 B8R0.23 NC(CC(=O)[O-])C(=O)[O-] CNP0541821.0 [0,0,0,0,0,0|1,0,2]=3 60 B8R0.23 NC(CS(=O)=O)C(=O)O CNP0422129.0 [0,0,0,0,0,0|2,0,1]=3 61 B8R0.23 NC(C[Se](=O)O)C(=O)O CNP0053005.0 [0,0,0,0,0,0|2,0,0]=2 62 B8R0.23 N[C@@H](CC(=O)O)C(=O)O CNP0141839.1 [0,0,0,0,0,0|1,0,0]=1 63 B8R0.23 N[C@@H](CC(=O)O)C(=O)O CNP0334080.1 [0,0,0,0,0,0|1,0,0]=1 64 B8R0.23 N[C@@H](CC(Cl)Cl)C(=O)O CNP0220364.1 [0,0,0,0,0,0|3,0,1]=4 65 B8R0.23 N[C@@H](CS(=O)O)C(=O)O CNP0255086.1 [0,0,0,0,0,0|2,0,0]=2 66 B8R0.23 N[C@@H](C[S@@](=O)O)C(=O)O CNP0255086.4 [0,0,0,0,0,0|2,0,0]=2 67 B8R0.23 N[C@@H](C[S@](=O)O)C(=O)O CNP0255086.3 [0,0,0,0,0,0|2,0,0]=2 68 B8R0.23 N[C@@H](C[SH](=O)O)C(=O)O CNP0546202.2 [0,0,0,0,0,0|2,0,0]=2 69 B8R0.23 N[C@@H](C[S](=O)=O)C(=O)O CNP0002376.1 [0,0,0,0,0,0|2,0,1]=3 70 B8R0.23 N[C@@H](C[SeH](=O)=O)C(=O)O CNP0497016.1 [0,0,0,0,0,0|2,0,1]=3 71 B8R0.23 N[C@H](CC(=O)O)C(=O)O CNP0141839.2 [0,0,0,0,0,0|1,0,0]=1 72 B8R0.23 N[C@H](C[S@@](=O)O)C(=O)O CNP0255086.2 [0,0,0,0,0,0|2,0,0]=2 73 B8R0.23 N[C@H](C[SH](=O)O)C(=O)O CNP0546202.1 [0,0,0,0,0,0|2,0,0]=2 74 B8R0.23 O=C(O)C(=O)CP(=O)=O CNP0343422.0 [0,0,0,0,0,0|1,0,3]=4 75 B8R0.23 O=C(O)C(=O)CS(=O)O CNP0083680.0 [0,0,0,0,0,0|1,0,2]=3 76 B8R0.23 O=C(O)C=C(O)C(=O)O CNP0279115.0 [0,0,0,0,0,0|0,0,2]=2 77 B8R0.23 O=C(O)CC(=O)C(=O)O CNP0390338.0 [0,0,0,0,0,0|0,0,2]=2 78 B8R0.23 O=C(O)CC(Cl)C(=O)O CNP0082226.0 [0,0,0,0,0,0|1,0,0]=1 79 B8R0.23 O=C(O)CC(S)C(=O)O CNP0402003.0 [0,0,0,0,0,0|0,1,0]=1 80 B8R0.23 O=C(O)CN(O)C(=O)O CNP0547380.0 [0,0,0,0,0,0|1,0,0]=1 81 B8R0.23 O=C(O)C[C@@H](O)C(=O)O CNP0152510.2 [0,0,0,0,0,0|0,0,0]=0 82 B8R0.23 O=C(O)C[C@H](O)C(=O)O CNP0152510.1 [0,0,0,0,0,0|0,0,0]=0 83 B8R0.23 O=C(O)[13CH2][C@@H](O)C(=O)O CNP0152510.3 [0,0,0,0,0,0|0,0,0]=0 84 B8R0.23 O=C(O)[C@H](O)C=C(O)O CNP0478842.1 [0,0,0,0,0,0|0,0,2]=2 85 B8R0.23 O=C([Na])C[C@@H](O)C(=O)[Na] CNP0467255.1 [0,0,0,0,0,0|2,0,0]=2 86 B8R0.23 O=C([O-])CC(O)C(=O)O CNP0534895.0 [0,0,0,0,0,0|0,0,1]=1 87 B8R0.23 O=C([O-])CC([S-])C(=O)[O-] CNP0547285.0 [0,0,0,0,0,0|0,1,2]=3 88 B7R0.2 C=C[C@H](O)CC(=O)O CNP0357372.1 [1,0,0,0,0,0|1,0,0]=2 89 B7R0.2 CC(=O)OC(C)C=O CNP0528164.0 [1,0,0,0,0,0|3,0,0]=4 90 B7R0.2 CC(CO)CC(=O)O CNP0350905.0 [1,0,0,0,0,0|1,0,1]=3 91 B7R0.2 CC=C(C)CC(=O)O CNP0178168.0 [1,0,0,0,0,0|2,0,1]=4 92 B7R0.2 CC[C@@H](C)CC(=O)O CNP0258429.2 [1,0,0,0,0,0|2,0,1]=4 93 B7R0.2 CC[C@H](C)CC(=O)O CNP0258429.1 [1,0,0,0,0,0|2,0,1]=4 94 B7R0.2 CC[C@H](O)CC(=O)N CNP0018371.1 [1,0,0,0,0,0|2,0,1]=4 95 B7R0.2 CC[C@H](O)CC(=O)O CNP0308552.1 [1,0,0,0,0,0|1,0,1]=3 96 B7R0.2 C[C@@H](O)C[C@H](N)C=O CNP0116023.1 [1,0,0,0,0,0|2,0,1]=4 97 B7R0.2 C[C@H](O)C[C@H](N)C=O CNP0116023.2 [1,0,0,0,0,0|2,0,1]=4 98 B7R0.2 NC[C@@H](N)CC(=O)O CNP0190172.1 [1,0,0,0,0,0|2,0,1]=4 99 B7R0.2 NC[C@@H](O)CC(=O)O CNP0335183.1 [1,0,0,0,0,0|1,0,1]=3 100 B7R0.2 NC[C@H](N)CC(=O)O CNP0190172.2 [1,0,0,0,0,0|2,0,1]=4 101 B7R0.2 NC[C@H](O)CC(=O)O CNP0335183.2 [1,0,0,0,0,0|1,0,1]=3 102 B7R0.2 N[C@@H](CS)CC(=O)O CNP0534853.1 [1,0,0,0,0,0|1,1,1]=4 103 B7R0.2 N[C@H](C=O)CC(=O)O CNP0335008.1 [1,0,0,0,0,0|1,0,0]=2 104 B7R0.2 N[C@H](CO)CC(=O)O CNP0415784.1 [1,0,0,0,0,0|1,0,1]=3 105 B7R0.2 O=C(O)C[C@H](O)CO CNP0269358.1 [1,0,0,0,0,0|0,0,1]=2 106 B7R0.2 O=CN(O)CC(=O)O CNP0278033.0 [1,0,0,0,0,0|1,0,0]=2 107 B7R0.5 C#CC[C@@H](N)C(=O)O CNP0149987.1 [1,0,0,0,0,0|2,0,1]=4 108 B7R0.5 C#CC[C@H](N)C(=O)O CNP0149987.2 [1,0,0,0,0,0|2,0,1]=4 109 B7R0.5 C=C(CCO)C(=O)O CNP0185726.0 [1,0,0,0,0,0|1,0,2]=4 110 B7R0.5 C=CC=C(O)C(=O)O CNP0566102.0 [1,0,0,0,0,0|1,0,2]=4 111 B7R0.5 C=CCC(C)C(=O)O CNP0293941.0 [1,0,0,0,0,0|2,0,0]=3 112 B7R0.5 C=CC[C@@H](N)C(=O)O CNP0299155.1 [1,0,0,0,0,0|2,0,0]=3 113 B7R0.5 C=CC[C@H](N)C(=O)O CNP0299155.2 [1,0,0,0,0,0|2,0,0]=3 114 B7R0.5 CC=CC(C)C(=O)O CNP0085321.0 [1,0,0,0,0,0|2,0,1]=4 115 B7R0.5 CCC[C@@H](C)C(=O)O CNP0218134.2 [1,0,0,0,0,0|2,0,1]=4 116 B7R0.5 CCC[C@@H](N)C(=O)O CNP0198245.2 [1,0,0,0,0,0|2,0,1]=4 117 B7R0.5 CCC[C@@H](O)C(=O)C CNP0171062.1 [1,0,0,0,0,0|2,0,1]=4 118 B7R0.5 CCC[C@H](C)C(=O)O CNP0218134.1 [1,0,0,0,0,0|2,0,1]=4 119 B7R0.5 CCC[C@H](N)C(=O)O CNP0198245.1 [1,0,0,0,0,0|2,0,1]=4 120 B7R0.5 CCC[C@H](O)C(=O)O CNP0107771.1 [1,0,0,0,0,0|1,0,1]=3 121 B7R0.5 CNC[C@@H](N)C(=O)O CNP0237559.2 [1,0,0,0,0,0|3,0,0]=4 122 B7R0.5 CNC[C@H](N)C(=O)O CNP0237559.1 [1,0,0,0,0,0|3,0,0]=4 123 B7R0.5 CSC[C@@H](N)C(=O)O CNP0391530.2 [1,0,0,0,0,0|3,0,0]=4 124 B7R0.5 CSC[C@H](N)C(=O)O CNP0391530.1 [1,0,0,0,0,0|3,0,0]=4 125 B7R0.5 C[C@@H](CCN)C(=O)O CNP0117278.1 [1,0,0,0,0,0|2,0,1]=4 126 B7R0.5 C[C@H](CCN)C(=O)O CNP0117278.2 [1,0,0,0,0,0|2,0,1]=4 127 B7R0.5 C[Se]C[C@H](N)C(=O)O CNP0420303.1 [1,0,0,0,0,0|3,0,0]=4 128 B7R0.5 N#CC[C@@H](N)C(=O)O CNP0254991.2 [1,0,0,0,0,0|2,0,1]=4 129 B7R0.5 N#CC[C@H](N)C(=O)O CNP0254991.1 [1,0,0,0,0,0|2,0,1]=4 130 B7R0.5 NC(C[S]=O)C(=O)O CNP0289741.0 [1,0,0,0,0,0|2,0,0]=3 131 B7R0.5 NCC[C@@H](N)C(=O)O CNP0283118.2 [1,0,0,0,0,0|2,0,1]=4 132 B7R0.5 NCC[C@H](N)C(=O)O CNP0283118.1 [1,0,0,0,0,0|2,0,1]=4 133 B7R0.5 NOCC(N)C(=O)O CNP0338620.0 [1,0,0,0,0,0|3,0,0]=4 134 B7R0.5 N[C@@H](CC=O)C(=O)O CNP0119915.1 [1,0,0,0,0,0|1,0,0]=2 135 B7R0.5 N[C@@H](CCO)C(=O)O CNP0287745.2 [1,0,0,0,0,0|1,0,1]=3 136 B7R0.5 N[C@@H](CCS)C(=O)O CNP0193002.1 [1,0,0,0,0,0|1,1,1]=4 137 B7R0.5 N[C@@H](CC[SeH])C(=O)O CNP0083667.1 [1,0,0,0,0,0|1,1,1]=4 138 B7R0.5 N[C@@H](CSO)C(=O)O CNP0559160.1 [1,0,0,0,0,0|2,0,0]=3 139 B7R0.5 N[C@@H](CSS)C(=O)O CNP0101794.1 [1,0,0,0,0,0|2,1,0]=4 140 B7R0.5 N[C@@H](CS[SeH])C(=O)O CNP0603953.1 [1,0,0,0,0,0|2,1,0]=4 141 B7R0.5 N[C@@H](C[S+]=O)C(=O)O CNP0587703.1 [1,0,0,0,0,0|2,0,0]=3 142 B7R0.5 N[C@H](CC=O)C(=O)O CNP0119915.2 [1,0,0,0,0,0|1,0,0]=2 143 B7R0.5 N[C@H](CCO)C(=O)O CNP0287745.3 [1,0,0,0,0,0|1,0,1]=3 144 B7R0.5 N[C@H](CCS)C(=O)O CNP0193002.2 [1,0,0,0,0,0|1,1,1]=4 145 B7R0.5 N[C@H](CSS)C(=O)O CNP0101794.2 [1,0,0,0,0,0|2,1,0]=4 146 B7R0.5 O=C(O)C(=O)CCO CNP0361332.0 [1,0,0,0,0,0|0,0,3]=4 147 B7R0.5 O=C(O)C(O)CCO CNP0218005.0 [1,0,0,0,0,0|0,0,1]=2 148 B7R0.5 O=CCC(=O)C(=O)O CNP0065471.0 [1,0,0,0,0,0|0,0,2]=3 149 B7R0.6 C=C(C)CCC(=O)C CNP0003362.0 [1,0,0,0,0,0|3,0,0]=4 150 B7R0.6 CC(=CCC(=O)O)C CNP0178388.0 [1,0,0,0,0,0|2,0,1]=4 151 B7R0.6 CC(=O)C=CC(=O)O CNP0237218.0 [1,0,0,0,0,0|1,0,2]=4 152 B7R0.6 CC(=O)CCC(=O)C CNP0291926.0 [1,0,0,0,0,0|2,0,0]=3 153 B7R0.6 CC(=O)CCC(=O)O CNP0267906.0 [1,0,0,0,0,0|1,0,0]=2 154 B7R0.6 CC(=O)CCC(=O)[O-] CNP0515624.0 [1,0,0,0,0,0|1,0,1]=3 155 B7R0.6 CC(=O)CCC(=O)[O-] CNP0577778.0 [1,0,0,0,0,0|1,0,1]=3 156 B7R0.6 CC(=O)COC(=O)C CNP0316161.0 [1,0,0,0,0,0|3,0,0]=4 157 B7R0.6 CC(=O)NCC(=O)O CNP0232085.0 [1,0,0,0,0,0|2,0,0]=3 158 B7R0.6 CC(C)CCC(=O)O CNP0414918.0 [1,0,0,0,0,0|2,0,1]=4 159 B7R0.6 CS(C)CCC(=O)O CNP0168459.0 [1,0,0,0,0,0|3,0,0]=4 160 B7R0.6 C[C@H](O)CCC(=O)O CNP0154959.1 [1,0,0,0,0,0|1,0,1]=3 161 B7R0.6 C[S+](C)CCC(=O)O CNP0349807.0 [1,0,0,0,0,0|3,0,0]=4 162 B7R0.6 C[S+](C)CCC(=O)O CNP0550706.0 [1,0,0,0,0,0|3,0,0]=4 163 B7R0.6 C[S@+]([O-])CCC(=O)O CNP0497394.1 [1,0,0,0,0,0|2,0,1]=4 164 B7R0.6 C[S](C)CCC(=O)O CNP0603322.0 [1,0,0,0,0,0|3,0,0]=4 165 B7R0.6 N=C(N)NCC(=O)O CNP0177921.0 [1,0,0,0,0,0|3,0,0]=4 166 B7R0.6 N=C(O)C=CC(=O)O CNP0546682.0 [1,0,0,0,0,0|1,0,2]=4 167 B7R0.6 NC(=NCC(=O)O)N CNP0491691.0 [1,0,0,0,0,0|3,0,0]=4 168 B7R0.6 NC(=O)C=CC(=O)O CNP0299428.0 [1,0,0,0,0,0|1,0,2]=4 169 B7R0.6 NC(=O)CCC(=O)N CNP0188909.0 [1,0,0,0,0,0|2,0,0]=3 170 B7R0.6 NC(=O)CCC(=O)O CNP0115008.0 [1,0,0,0,0,0|1,0,0]=2 171 B7R0.6 NC(=O)NCC(=O)O CNP0369831.0 [1,0,0,0,0,0|2,0,0]=3 172 B7R0.6 O=C(Br)CCC(=O)Br CNP0117937.0 [1,0,0,0,0,0|2,0,0]=3 173 B7R0.6 O=C(Cl)CCC(=O)Cl CNP0384530.0 [1,0,0,0,0,0|2,0,0]=3 174 B7R0.6 O=C(Cl)CC[N+](=O)[O-] CNP0468600.0 [1,0,0,0,0,0|2,0,1]=4 175 B7R0.6 O=C(O)C#CC(=O)O CNP0197927.0 [1,0,0,0,0,0|0,0,2]=3 176 B7R0.6 O=C(O)C=CC(=O)O CNP0289193.0 [1,0,0,0,0,0|0,0,2]=3 177 B7R0.6 O=C(O)CCC(=O)O CNP0332012.0 [1,0,0,0,0,0|0,0,0]=1 178 B7R0.6 O=C(O)CC[N+](=O)[O-] CNP0337272.0 [1,0,0,0,0,0|1,0,1]=3 179 B7R0.6 O=C(O)CNC(=O)O CNP0611653.0 [1,0,0,0,0,0|1,0,0]=2 180 B7R0.6 O=C(O)CN[N+](=O)[O-] CNP0570107.0 [1,0,0,0,0,0|2,0,1]=4 181 B7R0.6 O=C([O-])C=CC(=O)O CNP0594402.0 [1,0,0,0,0,0|0,0,3]=4 182 B7R0.6 O=C([O-])CCC(=O)[O-] CNP0594813.0 [1,0,0,0,0,0|0,0,2]=3 183 B9R0.11 CC(=O)NC(C)(C)C(=O)O CNP0548833.0 [0,1,0,0,0,0|3,0,0]=4 184 B9R0.11 CC(=O)OC(C)(C)C(=O)O CNP0299656.0 [0,1,0,0,0,0|3,0,0]=4 185 B9R0.11 CC(C)(CC(=O)O)C(=O)O CNP0354982.0 [0,1,0,0,0,0|1,0,0]=2 186 B9R0.11 CC(C)[C@@](C)(O)CC(=O)O CNP0235534.2 [0,1,0,0,0,0|2,0,1]=4 187 B9R0.11 CC(C)[C@](C)(O)CC(=O)O CNP0235534.1 [0,1,0,0,0,0|2,0,1]=4 188 B9R0.11 C[C@@](O)(CC(=O)O)C(=O)O CNP0272259.2 [0,1,0,0,0,0|0,0,0]=1 189 B9R0.11 C[C@](N)(CC(=O)O)C(=O)O CNP0128541.1 [0,1,0,0,0,0|1,0,0]=2 190 B9R0.11 C[C@](O)(CC(=O)O)C(=O)O CNP0272259.1 [0,1,0,0,0,0|0,0,0]=1 191 B9R0.23 COC(=O)C(=CC(=O)O)C CNP0215692.0 [0,1,0,0,0,0|1,0,2]=4 192 B9R0.23 COC(=O)C(C)CC(=O)O CNP0352524.0 [0,1,0,0,0,0|1,0,0]=2 193 B9R0.23 COC(=O)C(O)CC(C)C CNP0002916.0 [0,1,0,0,0,0|2,0,1]=4 194 B9R0.23 COC(=O)[C@@H](N)CC(=O)N CNP0041402.1 [0,1,0,0,0,0|2,0,0]=3 195 B9R0.23 COC(=O)[C@@H](O)CC(=O)C CNP0113476.2 [0,1,0,0,0,0|1,0,0]=2 196 B9R0.23 COC(=O)[C@H](N)CC(=O)N CNP0041402.2 [0,1,0,0,0,0|2,0,0]=3 197 B9R0.23 COC(=O)[C@H](O)CC(=O)C CNP0113476.1 [0,1,0,0,0,0|1,0,0]=2 198 B9R0.23 COC(=O)[C@H](O)CC(=O)O CNP0269332.1 [0,1,0,0,0,0|0,0,0]=1 199 B9R0.23 NC(CC(=O)O)C(=O)O[K+] CNP0611577.0 [0,1,0,0,0,0|1,0,0]=2 200 B9R0.23 N[C@H](CC(=O)O)C(=O)O[K+] CNP0611577.1 [0,1,0,0,0,0|1,0,0]=2 201 B9R0.23 O=C(O)C[C@H](O)[C@H](O)CO CNP0393490.1 [0,1,0,0,0,0|0,0,2]=3 202 B9R0.39 CC(=O)N[C@@H](CO)C(=O)O CNP0157865.1 [0,1,0,0,0,0|2,0,0]=3 203 B9R0.39 CC(=O)N[C@@H](CS)C(=O)O CNP0541980.2 [0,1,0,0,0,0|2,1,0]=4 204 B9R0.39 CC(=O)N[C@H](CO)C(=O)O CNP0157865.2 [0,1,0,0,0,0|2,0,0]=3 205 B9R0.39 CC(=O)N[C@H](CS)C(=O)O CNP0541980.1 [0,1,0,0,0,0|2,1,0]=4 206 B9R0.39 CC(C)C[C@H](NO)C(=O)O CNP0205469.1 [0,1,0,0,0,0|2,0,1]=4 207 B9R0.39 CN[C@@H](CC(=O)O)C(=O)O CNP0177941.1 [0,1,0,0,0,0|1,0,0]=2 208 B9R0.39 CN[C@H](CC(=O)O)C(=O)O CNP0177941.2 [0,1,0,0,0,0|1,0,0]=2 209 B9R0.39 COC(=CC(=O)O)C(=O)O CNP0187597.0 [0,1,0,0,0,0|0,0,2]=3 210 B9R0.39 CO[C@@H](C[S+](C)C)C(=O)O CNP0328625.1 [0,1,0,0,0,0|3,0,0]=4 211 B9R0.39 O=C(O)CC(=NO)C(=O)O CNP0331381.0 [0,1,0,0,0,0|0,0,1]=2 212 B9R0.39 O=C(O)CC(S[Au])C(=O)[O-] CNP0546891.0 [0,1,0,0,0,0|0,1,1]=3 213 B9R0.39 O=C(O)C[C@H](NO)C(=O)O CNP0495196.1 [0,1,0,0,0,0|0,0,0]=1 214 B9R0.42 C#C[C@@H](O)C[C@@H](N)C(=O)O CNP0239105.1 [0,1,0,0,0,0|2,0,1]=4 215 B9R0.42 C/C=C(/C)\C[C@H](N)C(=O)O CNP0271442.1 [0,1,0,0,0,0|3,0,0]=4 216 B9R0.42 C/C=C(\C)/C[C@H](N)C(=O)O CNP0271442.2 [0,1,0,0,0,0|3,0,0]=4 217 B9R0.42 C=C(CC(=O)OC)C(=O)O CNP0268165.0 [0,1,0,0,0,0|1,0,1]=3 218 B9R0.42 C=C(CC)C[C@H](N)C(=O)O CNP0154290.1 [0,1,0,0,0,0|3,0,0]=4 219 B9R0.42 CC(CC(=O)CCl)C(=O)O CNP0506666.0 [0,1,0,0,0,0|2,0,0]=3 220 B9R0.42 CCC(=O)C[C@H](N)C(=O)O CNP0276322.1 [0,1,0,0,0,0|2,0,0]=3 221 B9R0.42 CCC(O)C[C@H](N)C(=O)O CNP0517544.1 [0,1,0,0,0,0|2,0,1]=4 222 B9R0.42 COC(=O)C[C@@H](C)C(=O)C CNP0265875.1 [0,1,0,0,0,0|2,0,0]=3 223 B9R0.42 COC(=O)C[C@@H](N)C(=O)O CNP0082293.1 [0,1,0,0,0,0|1,0,0]=2 224 B9R0.42 COC(=O)C[C@@H](O)C(=O)O CNP0134370.1 [0,1,0,0,0,0|0,0,0]=1 225 B9R0.42 C[C@@H](NC(=O)CN)C(=O)O CNP0299268.2 [0,1,0,0,0,0|3,0,0]=4 226 B9R0.42 C[C@@H](O)[C@@H](O)C[C@@H](O)C=O CNP0164103.1 [0,1,0,0,0,0|1,0,2]=4 227 B9R0.42 C[C@H](NC(=O)CN)C(=O)O CNP0299268.1 [0,1,0,0,0,0|3,0,0]=4 228 B9R0.42 C[C@H](O)[C@@H](O)C[C@H](O)C=O CNP0164103.2 [0,1,0,0,0,0|1,0,2]=4 229 B9R0.42 NC[C@@H](O)C[C@H](N)C(=O)O CNP0310937.1 [0,1,0,0,0,0|2,0,1]=4 230 B9R0.42 NC[C@H](O)C[C@H](N)C(=O)O CNP0310937.2 [0,1,0,0,0,0|2,0,1]=4 231 B9R0.42 N[C@@H](CC(=O)CO)C(=O)O CNP0170448.1 [0,1,0,0,0,0|1,0,0]=2 232 B9R0.42 N[C@@H](CC(=O)NO)C(=O)O CNP0289364.1 [0,1,0,0,0,0|1,0,0]=2 233 B9R0.42 N[C@@H](CN(O)N=O)C(=O)O CNP0186686.1 [0,1,0,0,0,0|2,0,0]=3 234 B9R0.42 N[C@@H](C[C@@H](O)C=O)C(=O)O CNP0264056.1 [0,1,0,0,0,0|1,0,1]=3 235 B9R0.42 N[C@@H](C[C@H](O)CO)C(=O)O CNP0364941.1 [0,1,0,0,0,0|1,0,2]=4 236 B9R0.42 N[C@@H](C[N+](=NO)[O-])C(=O)O CNP0568394.1 [0,1,0,0,0,0|2,0,1]=4 237 B9R0.42 O=C(O)C(O)CC(O)CO CNP0583941.0 [0,1,0,0,0,0|0,0,2]=3 238 B9R0.57 CC(C)(O)C[C@H](N)C(=O)O CNP0190763.1 [0,1,0,0,0,0|2,0,1]=4 239 B9R0.57 C[C@@H](OP(=O)(O)O)C(=O)O CNP0541755.1 [0,1,0,0,0,0|3,0,0]=4 240 B9R0.57 C[Se](=O)(=O)C[C@H](N)C(=O)O CNP0250364.1 [0,1,0,0,0,0|2,0,1]=4 241 B9R0.57 NC(=O)[C@@H](N)CS(=O)(=O)O CNP0330582.1 [0,1,0,0,0,0|3,0,0]=4 242 B9R0.57 N[C@@H](CP(=O)(O)O)C(=O)O CNP0302280.1 [0,1,0,0,0,0|2,0,0]=3 243 B9R0.57 N[C@@H](CS(=O)(=O)O)C(=O)O CNP0171540.1 [0,1,0,0,0,0|2,0,0]=3 244 B9R0.57 N[C@@H](C[Se](=O)(=O)O)C(=O)O CNP0178375.1 [0,1,0,0,0,0|2,0,0]=3 245 B9R0.57 N[C@H](CP(=O)(O)O)C(=O)O CNP0302280.2 [0,1,0,0,0,0|2,0,0]=3 246 B9R0.57 N[C@H](CS(=O)(=O)O)C(=O)O CNP0171540.2 [0,1,0,0,0,0|2,0,0]=3 247 B9R0.57 O=C(O)C(=O)CP(=O)(O)O CNP0170314.0 [0,1,0,0,0,0|1,0,2]=4 248 B9R0.57 O=C(O)C(=O)CS(=O)(=O)O CNP0249927.0 [0,1,0,0,0,0|1,0,2]=4 249 B9R0.57 O=C(O)[C@@H](O)CS(=O)(=O)O CNP0441591.2 [0,1,0,0,0,0|1,0,0]=2 250 B9R0.57 O=C(O)[C@H](O)CS(=O)(=O)O CNP0441591.1 [0,1,0,0,0,0|1,0,0]=2 251 B9R0.79 C=C(C(=C)C(=O)O)C(=O)O CNP0156637.0 [0,1,0,0,0,0|1,0,2]=4 252 B9R0.79 C=C(O)C(O)C(O)C(=C)O CNP0085612.0 [0,1,0,0,0,0|2,0,0]=3 253 B9R0.79 CC(=C(C)C(=O)O)C(=O)O CNP0229389.0 [0,1,0,0,0,0|1,0,2]=4 254 B9R0.79 CC(=O)[C@@H](C)[C@H](N)C(=O)O CNP0368722.1 [0,1,0,0,0,0|2,0,0]=3 255 B9R0.79 CC(C(=O)O)C(O)C(=O)O CNP0389403.0 [0,1,0,0,0,0|0,0,0]=1 256 B9R0.79 CC(C)[C@@H](O)[C@H](N)C(=O)O CNP0145515.1 [0,1,0,0,0,0|2,0,1]=4 257 B9R0.79 CC(C)[C@H](O)[C@H](N)C(=O)O CNP0145515.2 [0,1,0,0,0,0|2,0,1]=4 258 B9R0.79 CC(O)[C@H](C)[C@H](N)C(=O)O CNP0207254.1 [0,1,0,0,0,0|2,0,1]=4 259 B9R0.79 C[C@@H](C(=O)O)[C@H](N)C(=O)O CNP0165783.3 [0,1,0,0,0,0|1,0,0]=2 260 B9R0.79 C[C@@H](O)[C@@H](O)[C@@H](O)C(=O)O CNP0145272.1 [0,1,0,0,0,0|1,0,1]=3 261 B9R0.79 C[C@@H]([C@@H](C)O)[C@@H](N)C(=O)O CNP0207254.6 [0,1,0,0,0,0|2,0,1]=4 262 B9R0.79 C[C@@H]([C@H](C)O)[C@@H](N)C(=O)O CNP0207254.7 [0,1,0,0,0,0|2,0,1]=4 263 B9R0.79 C[C@@H]([C@H](C)O)[C@H](N)C(=O)O CNP0207254.3 [0,1,0,0,0,0|2,0,1]=4 264 B9R0.79 C[C@@H]([C@H](N)C(=O)O)[C@@H](C)O CNP0207254.4 [0,1,0,0,0,0|2,0,1]=4 265 B9R0.79 C[C@H](C(=O)O)[C@@H](N)C(=O)O CNP0165783.1 [0,1,0,0,0,0|1,0,0]=2 266 B9R0.79 C[C@H](C(=O)O)[C@H](N)C(=O)O CNP0165783.2 [0,1,0,0,0,0|1,0,0]=2 267 B9R0.79 C[C@H]([C@@H](C)O)[C@@H](N)C(=O)O CNP0207254.5 [0,1,0,0,0,0|2,0,1]=4 268 B9R0.79 C[C@H]([C@H](N)C(=O)O)[C@@H](C)O CNP0207254.2 [0,1,0,0,0,0|2,0,1]=4 269 B9R0.79 NC(=O)[C@@H](O)[C@H](N)C(=O)O CNP0276088.1 [0,1,0,0,0,0|1,0,0]=2 270 B9R0.79 NC(=O)[C@H](O)[C@@H](O)C(=O)N CNP0226713.1 [0,1,0,0,0,0|2,0,0]=3 271 B9R0.79 NC(=O)[C@H](O)[C@H](N)C(=O)O CNP0276088.2 [0,1,0,0,0,0|1,0,0]=2 272 B9R0.79 N[C@@H](C(=O)O)[C@@H](O)C(=O)O CNP0233335.3 [0,1,0,0,0,0|0,0,0]=1 273 B9R0.79 N[C@@H](C(=O)O)[C@H](O)C(=O)O CNP0233335.4 [0,1,0,0,0,0|0,0,0]=1 274 B9R0.79 N[C@H](C(=O)O)[C@@H](O)C(=O)O CNP0233335.2 [0,1,0,0,0,0|0,0,0]=1 275 B9R0.79 N[C@H](C(=O)O)[C@H](N)C(=O)O CNP0266358.1 [0,1,0,0,0,0|1,0,0]=2 276 B9R0.79 N[C@H](C(=O)O)[C@H](O)C(=O)O CNP0233335.1 [0,1,0,0,0,0|0,0,0]=1 277 B9R0.79 O=C(O)C(=C(O)C(=O)O)O CNP0237095.0 [0,1,0,0,0,0|0,0,2]=3 278 B9R0.79 O=C(O)C(=O)C(=C(O)O)O CNP0190522.0 [0,1,0,0,0,0|0,0,3]=4 279 B9R0.79 O=C(O)C(O)C(O)C(=O)O CNP0549774.0 [0,1,0,0,0,0|0,0,0]=1 280 B9R0.79 O=C(O)[C@@H](Br)[C@@H](Br)C(=O)O CNP0444588.2 [0,1,0,0,0,0|1,0,0]=2 281 B9R0.79 O=C(O)[C@@H](Br)[C@H](Br)C(=O)O CNP0444588.1 [0,1,0,0,0,0|1,0,0]=2 282 B9R0.79 O=C(O)[C@@H](O)[C@@H](O)C(=O)O CNP0131308.3 [0,1,0,0,0,0|0,0,0]=1 283 B9R0.79 O=C(O)[C@@H](O)[C@H](O)C(=O)O CNP0131308.1 [0,1,0,0,0,0|0,0,0]=1 284 B9R0.79 O=C(O)[C@@H](S)[C@@H](S)C(=O)O CNP0437061.1 [0,1,0,0,0,0|0,1,0]=2 285 B9R0.79 O=C(O)[C@H](Br)[C@@H](Br)C(=O)O CNP0444588.3 [0,1,0,0,0,0|1,0,0]=2 286 B9R0.79 O=C(O)[C@H](O)[C@@H](O)C(=O)O CNP0131308.2 [0,1,0,0,0,0|0,0,0]=1 287 B9R0.79 O=C([O-])C(O)C(O)C(=O)O CNP0547326.0 [0,1,0,0,0,0|0,0,1]=2 288 B9R0.79 O=C([O-])C(O)C(O)C(=O)O CNP0567725.0 [0,1,0,0,0,0|0,0,1]=2 289 B9R0.79 O=C([O-])C(O)C(O)C(=O)[O-] CNP0548568.0 [0,1,0,0,0,0|0,0,2]=3 290 B9R0.79 O=C([O-])C(O)C(O)C(=O)[O-] CNP0563528.0 [0,1,0,0,0,0|0,0,2]=3 291 B9R0.79 O=C([O-])[C@H](O)[C@@H](O)C(=O)O CNP0542801.1 [0,1,0,0,0,0|0,0,1]=2 292 B9R0.79 O=C([O-])[C@H](O)[C@@H](O)C(=O)O CNP0584343.1 [0,1,0,0,0,0|0,0,1]=2 293 B9R0.79 O=C([O-])[C@H](O)[C@@H](O)C(=O)[O-] CNP0536809.1 [0,1,0,0,0,0|0,0,2]=3 294 B9R1.35 C=C1CN[C@@H](C1)C(=O)O CNP0129075.1 [0,0,0,1,0,0|3,0,0]=4 295 B9R1.35 CC(O)C1COC(=O)C1 CNP0564312.0 [0,0,0,1,0,0|2,0,1]=4 296 B9R1.35 O=C(O)[C@@H]1CC(CN1)O CNP0368925.2 [0,0,0,1,0,0|2,0,1]=4 297 B9R1.35 O=C(O)[C@@H]1CCC(=N1)O CNP0546413.2 [0,0,0,1,0,0|3,0,0]=4 298 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)O CNP0368925.3 [0,0,0,1,0,0|2,0,1]=4 299 B9R1.35 O=C(O)[C@@H]1C[C@H](C=N1)O CNP0313115.1 [0,0,0,1,0,0|2,0,1]=4 300 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)O CNP0368925.1 [0,0,0,1,0,0|2,0,1]=4 301 B9R1.35 O=C(O)[C@H]1CCC(=N1)O CNP0546413.1 [0,0,0,1,0,0|3,0,0]=4 302 B9R1.35 O=C(O)[C@H]1CSC(=S)C1 CNP0359055.1 [0,0,0,1,0,0|1,2,0]=4 303 B9R1.35 O=C(O)[C@H]1C[C@@H](C=N1)O CNP0313115.2 [0,0,0,1,0,0|2,0,1]=4 304 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)O CNP0368925.5 [0,0,0,1,0,0|2,0,1]=4 305 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)O CNP0368925.4 [0,0,0,1,0,0|2,0,1]=4 306 B9R1.35 O=C1CC[C@@H](N1)C(=O)O CNP0206174.1 [0,0,0,1,0,0|3,0,0]=4 307 B9R1.35 O=C1CC[C@@H](O1)C(=O)O CNP0464408.1 [0,0,0,1,0,0|3,0,0]=4 308 B9R1.35 O=C1CC[C@H](N1)C(=O)O CNP0206174.2 [0,0,0,1,0,0|3,0,0]=4 309 B9R1.35 O=C1CNC(C1)C(=O)O CNP0124683.0 [0,0,0,1,0,0|2,0,0]=3 310 B9R1.35 O=C1NCC(N1)C(=O)O CNP0324165.0 [0,0,0,1,0,0|3,0,0]=4 311 B9R1.35 O=C1N[C@@H](CS1)C(=O)O CNP0361457.2 [0,0,0,1,0,0|2,1,0]=4 312 B9R1.35 O=C1N[C@H](CS1)C(=O)O CNP0361457.1 [0,0,0,1,0,0|2,1,0]=4 313 B9R1.38 CC1(OC(=O)C[C@H]1O)C CNP0199015.1 [0,0,0,1,0,0|2,0,1]=4 314 B9R1.45 C=C1C[C@@H]1[C@H](N)C(=O)O CNP0108451.1 [0,0,0,1,0,0|3,0,0]=4 315 B9R1.45 C=C1C[C@H]1[C@@H](N)C(=O)O CNP0108451.2 [0,0,0,1,0,0|3,0,0]=4 316 B9R1.45 C=C1C[C@H]1[C@H](N)C(=O)O CNP0108451.3 [0,0,0,1,0,0|3,0,0]=4 317 B9R1.69 CC1CC(=O)OCC1O CNP0415088.0 [0,0,0,1,0,0|2,0,1]=4 318 B9R1.69 C[C@@H]1CC(=O)C=CC1=O CNP0273693.1 [0,0,0,1,0,0|3,0,0]=4 319 B9R1.69 O=C1C[C@H]([C@H](CO1)O)O CNP0254942.1 [0,0,0,1,0,0|1,0,1]=3 320 B9R1.112 N[C@@H](C[C@H]1CO1)C(=O)O CNP0511777.1 [0,0,0,1,0,0|2,0,1]=4 321 B9R1.161 O=C(O)[C@@H]1C[C@H]1C(=O)O CNP0465575.1 [0,0,0,1,0,0|1,0,0]=2 322 B9R1.161 O=C(O)[C@@H]1O[C@H]1C(=O)O CNP0251636.1 [0,0,0,1,0,0|0,0,0]=1 323 B9R1.161 O=C(O)[C@H]1C[C@@H]1C(=O)O CNP0465575.2 [0,0,0,1,0,0|1,0,0]=2 324 B9R1.161 O=C(O)[C@H]1C[C@H]1C(=O)O CNP0465575.3 [0,0,0,1,0,0|1,0,0]=2 325 B9R1.161 O=C(O)[C@H]1N[C@@H]1C(=O)O CNP0156205.1 [0,0,0,1,0,0|1,0,0]=2 326 B9R1.161 O=C(O)[C@H]1N[C@H]1C(=O)O CNP0156205.2 [0,0,0,1,0,0|1,0,0]=2 327 B9R1.161 O=C(O)[C@H]1O[C@@H]1C(=O)O CNP0251636.3 [0,0,0,1,0,0|0,0,0]=1 328 B9R1.161 O=C(O)[C@H]1O[C@H]1C(=O)O CNP0251636.2 [0,0,0,1,0,0|0,0,0]=1 329 B7R0.16 CC(=C(O)C(=O)O)C CNP0081972.0 [0,0,0,0,1,0|2,0,1]=4 330 B7R0.16 CC(=O)C(=N)C(=O)O CNP0486933.0 [0,0,0,0,1,0|2,0,1]=4 331 B7R0.16 CC(=O)C(C)C(=O)C CNP0423013.0 [0,0,0,0,1,0|3,0,0]=4 332 B7R0.16 CC(=O)C(C)C(=O)O CNP0002342.0 [0,0,0,0,1,0|2,0,0]=3 333 B7R0.16 CC(=O)[C@H](N)C(=O)O CNP0211201.1 [0,0,0,0,1,0|2,0,0]=3 334 B7R0.16 CC(C(=O)N)C(=O)N CNP0110933.0 [0,0,0,0,1,0|3,0,0]=4 335 B7R0.16 CC(C(=O)O)C(=O)O CNP0415806.0 [0,0,0,0,1,0|1,0,0]=2 336 B7R0.16 CC(C)[C@@H](O)C(=O)O CNP0267024.1 [0,0,0,0,1,0|2,0,1]=4 337 B7R0.16 CC(C)[C@H](O)C(=O)O CNP0267024.2 [0,0,0,0,1,0|2,0,1]=4 338 B7R0.16 CC(O)C(O)C(=O)N CNP0028681.0 [0,0,0,0,1,0|2,0,1]=4 339 B7R0.16 C[C@@H](C(=O)N)C(=O)O CNP0423688.1 [0,0,0,0,1,0|2,0,0]=3 340 B7R0.16 C[C@@H](O)C(N)C(=O)O CNP0361197.2 [0,0,0,0,1,0|2,0,1]=4 341 B7R0.16 C[C@@H](O)[C@@H](C)C(=O)O CNP0176980.1 [0,0,0,0,1,0|2,0,1]=4 342 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O CNP0361197.5 [0,0,0,0,1,0|2,0,1]=4 343 B7R0.16 C[C@@H](O)[C@@H](O)C(=O)O CNP0082312.1 [0,0,0,0,1,0|1,0,1]=3 344 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O CNP0361197.1 [0,0,0,0,1,0|2,0,1]=4 345 B7R0.16 C[C@@H](O)[C@H](O)C(=O)O CNP0082312.2 [0,0,0,0,1,0|1,0,1]=3 346 B7R0.16 C[C@H](C(=O)O)[C@@H](C)O CNP0176980.3 [0,0,0,0,1,0|2,0,1]=4 347 B7R0.16 C[C@H](O)[C@@H](C)C(=O)O CNP0176980.2 [0,0,0,0,1,0|2,0,1]=4 348 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O CNP0361197.4 [0,0,0,0,1,0|2,0,1]=4 349 B7R0.16 C[C@H](O)[C@H](C)C(=O)O CNP0176980.4 [0,0,0,0,1,0|2,0,1]=4 350 B7R0.16 C[C@H](O)[C@H](N)C(=O)O CNP0361197.3 [0,0,0,0,1,0|2,0,1]=4 351 B7R0.16 NC(C(=O)O)C(=O)O CNP0385563.0 [0,0,0,0,1,0|1,0,0]=2 352 B7R0.16 O=C(O)C(=O)C(=O)O CNP0307436.0 [0,0,0,0,1,0|0,0,2]=3 353 B7R0.16 O=C(O)C(O)C(=O)O CNP0230174.0 [0,0,0,0,1,0|0,0,0]=1 354 B9R0.7 C/C(=C/C[C@H](N)C(=O)O)/Cl CNP0126752.1 [0,0,0,0,0,1|3,0,0]=4 355 B9R0.7 C=C(C)CC[C@H](N)C(=O)O CNP0300764.1 [0,0,0,0,0,1|3,0,0]=4 356 B9R0.7 C=C(CCC(=O)O)C(=O)O CNP0610121.0 [0,0,0,0,0,1|1,0,1]=3 357 B9R0.7 C=C(Cl)CC[C@@H](N)C(=O)O CNP0253011.1 [0,0,0,0,0,1|3,0,0]=4 358 B9R0.7 C=C(Cl)CC[C@H](N)C(=O)O CNP0253011.2 [0,0,0,0,0,1|3,0,0]=4 359 B9R0.7 CC(=CCC(=O)O)C(=O)O CNP0023661.0 [0,0,0,0,0,1|1,0,1]=3 360 B9R0.7 CC(=CC[C@H](N)C(=O)O)C CNP0216742.1 [0,0,0,0,0,1|3,0,0]=4 361 B9R0.7 CC(=O)CCC(C)C(=O)O CNP0035936.0 [0,0,0,0,0,1|2,0,0]=3 362 B9R0.7 CC(=O)CC[C@H](N)C(=O)O CNP0029013.1 [0,0,0,0,0,1|2,0,0]=3 363 B9R0.7 CC(=O)NC[C@H](N)C(=O)O CNP0222847.1 [0,0,0,0,0,1|2,0,0]=3 364 B9R0.7 CC(=O)OCC(C)C(=O)O CNP0355270.0 [0,0,0,0,0,1|2,0,0]=3 365 B9R0.7 CC(=O)OC[C@H](N)C(=O)O CNP0343242.1 [0,0,0,0,0,1|2,0,0]=3 366 B9R0.7 CC(=O)SC[C@H](N)C(=O)O CNP0549128.1 [0,0,0,0,0,1|2,0,0]=3 367 B9R0.7 CC(=O)[C@@H](C)CCC(=O)O CNP0449435.1 [0,0,0,0,0,1|2,0,0]=3 368 B9R0.7 CC(=O)[C@H](C)CCC(=O)O CNP0449435.2 [0,0,0,0,0,1|2,0,0]=3 369 B9R0.7 CC(CCC(=O)O)C(=O)O CNP0184293.0 [0,0,0,0,0,1|1,0,0]=2 370 B9R0.7 CC(CNC(=O)N)C(=O)O CNP0374758.0 [0,0,0,0,0,1|2,0,0]=3 371 B9R0.7 CC(O)CC[C@H](N)C(=O)O CNP0295098.1 [0,0,0,0,0,1|2,0,1]=4 372 B9R0.7 C[C@H](NCC(=O)O)C(=O)O CNP0313110.1 [0,0,0,0,0,1|1,0,0]=2 373 B9R0.7 C[C@H](O)CC[C@H](N)C(=O)O CNP0295098.2 [0,0,0,0,0,1|2,0,1]=4 374 B9R0.7 C[C@H](O)[C@@H](O)/C=C/C(=O)O CNP0206491.1 [0,0,0,0,0,1|1,0,2]=4 375 B9R0.7 C[Se](=O)CC[C@H](N)C(=O)O CNP0028926.1 [0,0,0,0,0,1|3,0,0]=4 376 B9R0.7 NC(=O)CCC(=O)C(=O)O CNP0032107.0 [0,0,0,0,0,1|1,0,2]=4 377 B9R0.7 NC(=O)CC[C@@H](N)C(=O)O CNP0361973.2 [0,0,0,0,0,1|2,0,0]=3 378 B9R0.7 NC(=O)CC[C@H](N)C(=O)N CNP0387642.1 [0,0,0,0,0,1|3,0,0]=4 379 B9R0.7 NC(=O)CC[C@H](N)C(=O)O CNP0361973.1 [0,0,0,0,0,1|2,0,0]=3 380 B9R0.7 NC(=O)NC[C@@H](N)C(=O)O CNP0532146.2 [0,0,0,0,0,1|2,0,0]=3 381 B9R0.7 NC(=O)NC[C@H](N)C(=O)O CNP0532146.1 [0,0,0,0,0,1|2,0,0]=3 382 B9R0.7 NC(=O)OC[C@@H](N)C(=O)O CNP0393327.1 [0,0,0,0,0,1|2,0,0]=3 383 B9R0.7 NC(=O)[C@@H](N)CCC(=O)O CNP0595376.1 [0,0,0,0,0,1|2,0,0]=3 384 B9R0.7 NC(CCC(=O)O)C(=O)[O-] CNP0535517.0 [0,0,0,0,0,1|1,0,1]=3 385 B9R0.7 NC(CCS(=O)O)C(=O)O CNP0027333.0 [0,0,0,0,0,1|2,0,0]=3 386 B9R0.7 NC(CC[P+](=O)O)C(=O)O CNP0250837.0 [0,0,0,0,0,1|2,0,0]=3 387 B9R0.7 NC(CNC(=O)O)C(=O)O CNP0158277.0 [0,0,0,0,0,1|1,0,0]=2 388 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O CNP0191057.1 [0,0,0,0,0,1|1,0,0]=2 389 B9R0.7 N[C@@H](CCP(=O)O)C(=O)O CNP0424644.2 [0,0,0,0,0,1|2,0,0]=3 390 B9R0.7 N[C@@H](CC[P@@H](=O)O)C(=O)O CNP0424644.1 [0,0,0,0,0,1|2,0,0]=3 391 B9R0.7 N[C@@H](CN[N+](=O)[O-])C(=O)O CNP0526957.1 [0,0,0,0,0,1|2,0,1]=4 392 B9R0.7 N[C@@H](CS[As](O)O)C(=O)O CNP0546239.1 [0,0,0,0,0,1|2,0,1]=4 393 B9R0.7 N[C@H](CCC(=O)O)C(=O)O CNP0191057.2 [0,0,0,0,0,1|1,0,0]=2 394 B9R0.7 O=C(O)C(=O)CC[P@@H](=O)O CNP0360014.1 [0,0,0,0,0,1|1,0,2]=4 395 B9R0.7 O=C(O)CCC(=O)C(=O)O CNP0115442.0 [0,0,0,0,0,1|0,0,2]=3 396 B9R0.7 O=C(O)CC[C@@H](O)C(=O)O CNP0156996.1 [0,0,0,0,0,1|0,0,0]=1 397 B9R0.7 O=C(O)CC[C@H](O)C(=O)O CNP0156996.2 [0,0,0,0,0,1|0,0,0]=1 398 B9R0.7 O=C([O-])CCC(=O)C(=O)O CNP0505801.0 [0,0,0,0,0,1|0,0,3]=4 399 B9R0.53 CC(=CC(=O)O)CC(=O)O CNP0273372.0 [0,0,0,0,0,1|1,0,1]=3 400 B9R0.53 CC(=O)C[C@@H](C)OC(=O)C CNP0303654.1 [0,0,0,0,0,1|3,0,0]=4 401 B9R0.53 CC(=O)O[C@H](C)CC(=O)O CNP0305826.1 [0,0,0,0,0,1|2,0,0]=3 402 B9R0.53 CC(C)CC(O)CC(=O)O CNP0002352.0 [0,0,0,0,0,1|2,0,1]=4 403 B9R0.53 CC(CC(=O)O)CC(=O)O CNP0316583.0 [0,0,0,0,0,1|1,0,0]=2 404 B9R0.53 C[C@@H](CC(=O)O)O[N+](=O)[O-] CNP0602674.2 [0,0,0,0,0,1|2,0,1]=4 405 B9R0.53 C[C@H](CC(=O)O)O[N+](=O)[O-] CNP0602674.1 [0,0,0,0,0,1|2,0,1]=4 406 B9R0.53 NC(CC(=O)O)CC(=O)O CNP0324847.0 [0,0,0,0,0,1|1,0,0]=2 407 B9R0.53 O=C(O)CC(=O)CC(=O)O CNP0280291.0 [0,0,0,0,0,1|0,0,2]=3 408 B9R0.53 O=C(O)CC(O)CC(=O)O CNP0395942.0 [0,0,0,0,0,1|0,0,0]=1 409 B6R0.1 C=C(C=O)CC=O CNP0191239.0 [2,0,0,0,0,0|1,0,1]=4 410 B6R0.1 C=CC[C@H](C)C=O CNP0283012.1 [2,0,0,0,0,0|2,0,0]=4 411 B6R0.1 NC(C=O)CC=O CNP0515395.0 [2,0,0,0,0,0|1,0,0]=3 412 B6R0.1 OCC[C@H](O)CO CNP0190269.1 [2,0,0,0,0,0|0,0,2]=4 413 B6R0.1 OC[C@@H](O)CSO CNP0536094.1 [2,0,0,0,0,0|1,0,1]=4 414 B6R0.2 C=C(N)CC(=O)O CNP0312147.0 [2,0,0,0,0,0|1,0,1]=4 415 B6R0.2 C=C(O)CC(=O)O CNP0082070.0 [2,0,0,0,0,0|0,0,1]=3 416 B6R0.2 CC(=O)CC(=O)O CNP0286292.0 [2,0,0,0,0,0|1,0,1]=4 417 B6R0.2 CC(=O)C[C@@H](C)O CNP0209002.1 [2,0,0,0,0,0|1,0,1]=4 418 B6R0.2 CC(=O)C[C@H](C)O CNP0209002.2 [2,0,0,0,0,0|1,0,1]=4 419 B6R0.2 CC(O)CC(=O)N CNP0217857.0 [2,0,0,0,0,0|1,0,1]=4 420 B6R0.2 C[C@@H](N)CC(=O)O CNP0287180.2 [2,0,0,0,0,0|1,0,1]=4 421 B6R0.2 C[C@@H](O)CC(=O)O CNP0161860.1 [2,0,0,0,0,0|0,0,1]=3 422 B6R0.2 C[C@H](N)CC(=O)O CNP0287180.1 [2,0,0,0,0,0|1,0,1]=4 423 B6R0.2 C[C@H](O)CC(=O)O CNP0161860.2 [2,0,0,0,0,0|0,0,1]=3 424 B6R0.2 C[C@H]([13CH3])CC(=O)O CNP0175489.1 [2,0,0,0,0,0|1,0,1]=4 425 B6R0.2 NC(=O)CC(=O)O CNP0514577.0 [2,0,0,0,0,0|1,0,1]=4 426 B6R0.2 O=C(O)CC(=O)O CNP0327247.0 [2,0,0,0,0,0|0,0,1]=3 427 B6R0.4 C=CCCC(=O)C CNP0610109.0 [2,0,0,0,0,0|2,0,0]=4 428 B6R0.4 C=CCCC(=O)N CNP0118917.0 [2,0,0,0,0,0|2,0,0]=4 429 B6R0.4 C=CCCC(=O)O CNP0003359.0 [2,0,0,0,0,0|1,0,0]=3 430 B6R0.4 CC(=O)CCC=O CNP0261239.0 [2,0,0,0,0,0|1,0,0]=3 431 B6R0.4 CC=CCC(=O)O CNP0610144.0 [2,0,0,0,0,0|1,0,1]=4 432 B6R0.4 CCCCC(=O)O CNP0144818.0 [2,0,0,0,0,0|1,0,1]=4 433 B6R0.4 CCCC[11C](=O)O CNP0540258.0 [2,0,0,0,0,0|1,0,1]=4 434 B6R0.4 CNCCC(=O)O CNP0502963.0 [2,0,0,0,0,0|2,0,0]=4 435 B6R0.4 CSCCC(=O)O CNP0143779.0 [2,0,0,0,0,0|2,0,0]=4 436 B6R0.4 N=CNCC(=O)O CNP0218776.0 [2,0,0,0,0,0|2,0,0]=4 437 B6R0.4 NC(=O)CCCO CNP0573523.0 [2,0,0,0,0,0|1,0,1]=4 438 B6R0.4 NCCCC(=O)O CNP0116256.0 [2,0,0,0,0,0|1,0,1]=4 439 B6R0.4 O=C(O)CCCO CNP0236331.0 [2,0,0,0,0,0|0,0,1]=3 440 B6R0.4 O=C([O-])CCCO CNP0492590.0 [2,0,0,0,0,0|0,0,2]=4 441 B6R0.4 O=CCCC(=O)O CNP0318740.0 [2,0,0,0,0,0|0,0,0]=2 442 B6R0.4 O=CNCC(=O)O CNP0082901.0 [2,0,0,0,0,0|1,0,0]=3 443 B6R0.3 C=C[C@@H](N)C(=O)O CNP0240520.1 [2,0,0,0,0,0|1,0,1]=4 444 B6R0.3 C=C[C@H](N)C(=O)O CNP0240520.2 [2,0,0,0,0,0|1,0,1]=4 445 B6R0.3 CCC(O)C(=O)C CNP0413470.0 [2,0,0,0,0,0|1,0,1]=4 446 B6R0.3 CC[C@@H](C)C(=O)O CNP0187792.1 [2,0,0,0,0,0|1,0,1]=4 447 B6R0.3 CC[C@@H](N)C(=O)O CNP0243222.1 [2,0,0,0,0,0|1,0,1]=4 448 B6R0.3 CC[C@@H](O)C(=O)C CNP0413470.1 [2,0,0,0,0,0|1,0,1]=4 449 B6R0.3 CC[C@@H](O)C(=O)O CNP0162708.1 [2,0,0,0,0,0|0,0,1]=3 450 B6R0.3 CC[C@H](C)C(=O)O CNP0187792.2 [2,0,0,0,0,0|1,0,1]=4 451 B6R0.3 CC[C@H](N)C(=O)O CNP0243222.3 [2,0,0,0,0,0|1,0,1]=4 452 B6R0.3 CC[C@H](O)C(=O)O CNP0162708.2 [2,0,0,0,0,0|0,0,1]=3 453 B6R0.3 C[C@@H](C=O)C(=O)O CNP0083546.1 [2,0,0,0,0,0|1,0,0]=3 454 B6R0.3 C[C@@H](CN)C(=O)O CNP0291505.1 [2,0,0,0,0,0|2,0,0]=4 455 B6R0.3 C[C@@H](CO)C(=O)O CNP0257203.1 [2,0,0,0,0,0|1,0,0]=3 456 B6R0.3 C[C@@H](O)[C@@H](O)CO CNP0199934.3 [2,0,0,0,0,0|1,0,1]=4 457 B6R0.3 C[C@@H](O)[C@H](O)CO CNP0199934.1 [2,0,0,0,0,0|1,0,1]=4 458 B6R0.3 C[C@H](CN)C(=O)O CNP0291505.2 [2,0,0,0,0,0|2,0,0]=4 459 B6R0.3 C[C@H](CO)C(=O)O CNP0257203.2 [2,0,0,0,0,0|1,0,0]=3 460 B6R0.3 C[C@H](NO)C(=O)O CNP0221656.1 [2,0,0,0,0,0|2,0,0]=4 461 B6R0.3 C[C@H](O)[C@H](O)CO CNP0199934.2 [2,0,0,0,0,0|1,0,1]=4 462 B6R0.3 NC(=O)[C@@H](O)CO CNP0263493.1 [2,0,0,0,0,0|1,0,0]=3 463 B6R0.3 NC[C@@H](N)C(=O)O CNP0403048.1 [2,0,0,0,0,0|2,0,0]=4 464 B6R0.3 NC[C@@H](O)C(=O)O CNP0213687.1 [2,0,0,0,0,0|1,0,0]=3 465 B6R0.3 NC[C@H](N)C(=O)O CNP0403048.2 [2,0,0,0,0,0|2,0,0]=4 466 B6R0.3 N[C@@H](C=O)C(=O)O CNP0082836.1 [2,0,0,0,0,0|1,0,0]=3 467 B6R0.3 N[C@@H](CO)C(=O)O CNP0275512.1 [2,0,0,0,0,0|1,0,0]=3 468 B6R0.3 N[C@@H](CS)C(=O)O CNP0280490.1 [2,0,0,0,0,0|1,1,0]=4 469 B6R0.3 N[C@@H](CS)C(=O)O CNP0543246.1 [2,0,0,0,0,0|1,1,0]=4 470 B6R0.3 N[C@@H](C[SeH])C(=O)O CNP0105616.1 [2,0,0,0,0,0|1,1,0]=4 471 B6R0.3 N[C@@H](C[Se])C(=O)O CNP0539066.1 [2,0,0,0,0,0|1,1,0]=4 472 B6R0.3 N[C@H](CCl)C(=O)O CNP0597943.1 [2,0,0,0,0,0|2,0,0]=4 473 B6R0.3 N[C@H](CO)C(=O)O CNP0275512.2 [2,0,0,0,0,0|1,0,0]=3 474 B6R0.3 N[C@H](CS)C(=O)O CNP0280490.2 [2,0,0,0,0,0|1,1,0]=4 475 B6R0.3 N[C@H](C[SeH])C(=O)O CNP0105616.2 [2,0,0,0,0,0|1,1,0]=4 476 B6R0.3 O=C(O)C(=CO)O CNP0197473.0 [2,0,0,0,0,0|0,0,1]=3 477 B6R0.3 O=C(O)C(=O)CO CNP0343498.0 [2,0,0,0,0,0|0,0,2]=4 478 B6R0.3 O=C(O)[C@@H](O)CCl CNP0460792.2 [2,0,0,0,0,0|1,0,0]=3 479 B6R0.3 O=C(O)[C@@H](O)CO CNP0264905.2 [2,0,0,0,0,0|0,0,0]=2 480 B6R0.3 O=C(O)[C@@H](O)CS CNP0083519.1 [2,0,0,0,0,0|0,1,0]=3 481 B6R0.3 O=C(O)[C@H](O)CCl CNP0460792.1 [2,0,0,0,0,0|1,0,0]=3 482 B6R0.3 O=C(O)[C@H](O)CO CNP0264905.1 [2,0,0,0,0,0|0,0,0]=2 483 B6R0.3 O=CC(=O)C(=O)O CNP0106243.0 [2,0,0,0,0,0|0,0,2]=4 484 B6R0.3 O=CC(O)C(=O)O CNP0083603.0 [2,0,0,0,0,0|0,0,0]=2 485 B8R0.2 C#C[C@@H](O)[C@H](N)C(=O)O CNP0244576.1 [1,1,0,0,0,0|1,0,1]=4 486 B8R0.2 C=C(C(=O)O)[C@H](O)CO CNP0177304.1 [1,1,0,0,0,0|0,0,2]=4 487 B8R0.2 CC(=O)[C@@H](O)[C@H](O)CO CNP0176641.1 [1,1,0,0,0,0|1,0,1]=4 488 B8R0.2 CC(=O)[C@H](O)[C@H](O)CO CNP0176641.2 [1,1,0,0,0,0|1,0,1]=4 489 B8R0.2 CCC(O)C(O)C(=O)O CNP0042669.0 [1,1,0,0,0,0|1,0,1]=4 490 B8R0.2 CC[C@@H](O)[C@@H](C)C(=O)O CNP0152762.2 [1,1,0,0,0,0|1,0,1]=4 491 B8R0.2 CC[C@H](O)[C@@H](C)C(=O)O CNP0152762.1 [1,1,0,0,0,0|1,0,1]=4 492 B8R0.2 CC[C@H](O)[C@H](N)C(=O)O CNP0172440.1 [1,1,0,0,0,0|1,0,1]=4 493 B8R0.2 C[C@H](CO)[C@H](N)C(=O)O CNP0265775.1 [1,1,0,0,0,0|1,0,1]=4 494 B8R0.2 NC(=O)[C@H](O)[C@H](O)CO CNP0299919.1 [1,1,0,0,0,0|1,0,1]=4 495 B8R0.2 NC[C@@H](O)[C@H](O)C(=O)O CNP0266356.3 [1,1,0,0,0,0|1,0,1]=4 496 B8R0.2 NC[C@H](O)[C@@H](O)C(=O)O CNP0266356.2 [1,1,0,0,0,0|1,0,1]=4 497 B8R0.2 NC[C@H](O)[C@H](O)C(=O)O CNP0266356.1 [1,1,0,0,0,0|1,0,1]=4 498 B8R0.2 N[C@@H](C(=O)O)[C@@H](O)CCl CNP0343503.2 [1,1,0,0,0,0|1,0,1]=4 499 B8R0.2 N[C@@H](C(=O)O)[C@@H](O)CO CNP0267593.2 [1,1,0,0,0,0|0,0,1]=3 500 B8R0.2 N[C@@H](C(=O)O)[C@H](O)CO CNP0267593.4 [1,1,0,0,0,0|0,0,1]=3 501 B8R0.2 N[C@H](C(=O)O)[C@@H](O)CCl CNP0343503.1 [1,1,0,0,0,0|1,0,1]=4 502 B8R0.2 N[C@H](C(=O)O)[C@@H](O)CO CNP0267593.3 [1,1,0,0,0,0|0,0,1]=3 503 B8R0.2 N[C@H](C(=O)O)[C@H](O)CCl CNP0343503.3 [1,1,0,0,0,0|1,0,1]=4 504 B8R0.2 N[C@H](C(=O)O)[C@H](O)CO CNP0267593.1 [1,1,0,0,0,0|0,0,1]=3 505 B8R0.2 O=C(O)C(=O)C(O)CO CNP0611324.0 [1,1,0,0,0,0|0,0,2]=4 506 B8R0.2 O=C(O)[C@@H](O)[C@@H](O)CO CNP0144827.3 [1,1,0,0,0,0|0,0,1]=3 507 B8R0.2 O=C(O)[C@@H](O)[C@H](O)CO CNP0144827.1 [1,1,0,0,0,0|0,0,1]=3 508 B8R0.2 O=C(O)[C@H](O)[C@@H](O)CO CNP0144827.2 [1,1,0,0,0,0|0,0,1]=3 509 B8R0.2 O=C(O)[C@H](O)[C@H](O)CO CNP0144827.4 [1,1,0,0,0,0|0,0,1]=3 510 B8R0.2 O=C([O-])[C@H](O)[C@@H](O)CO CNP0144827.5 [1,1,0,0,0,0|0,0,2]=4 511 B8R0.5 C/C=C/[C@@H](O)CC(=O)O CNP0087305.2 [1,1,0,0,0,0|1,0,0]=3 512 B8R0.5 C/C=C/[C@H](O)CC(=O)O CNP0087305.1 [1,1,0,0,0,0|1,0,0]=3 513 B8R0.5 CCC[C@@H](O)CC(=O)O CNP0065850.1 [1,1,0,0,0,0|1,0,1]=4 514 B8R0.5 CCC[C@H](O)CC(=O)O CNP0065850.2 [1,1,0,0,0,0|1,0,1]=4 515 B8R0.5 COO[C@@H](O)CC(=O)O CNP0148715.1 [1,1,0,0,0,0|1,0,0]=3 516 B8R0.5 NCC[C@H](O)CC(=O)O CNP0229084.1 [1,1,0,0,0,0|1,0,1]=4 517 B8R0.19 CC[C@H](O)CC(=O)OC CNP0318883.1 [1,1,0,0,0,0|1,0,1]=4 518 B8R0.19 O=C(CO)C[C@@H](O)CO CNP0343552.1 [1,1,0,0,0,0|0,0,1]=3 519 B8R0.19 O=CC(=O)C[C@@H](O)CO CNP0343388.1 [1,1,0,0,0,0|0,0,2]=4 520 B8R0.24 O=C[C@@H](O)CS(=O)(=O)O CNP0082232.1 [1,1,0,0,0,0|1,0,0]=3 521 B8R0.24 O=S(=O)(O)C[C@@H](O)CO CNP0018749.1 [1,1,0,0,0,0|1,0,1]=4 522 B8R0.34 CC[C@@](C)(O)CC(=O)O CNP0379279.1 [1,1,0,0,0,0|1,0,1]=4 523 B8R0.3 O=CC[C@@H](O)[C@@H](O)CO CNP0204667.2 [1,1,0,0,0,0|0,0,2]=4 524 B8R0.3 O=CC[C@H](O)[C@H](O)CO CNP0204667.1 [1,1,0,0,0,0|0,0,2]=4 525 B8R0.8 C/C=C/C[C@H](N)C(=O)O CNP0134361.1 [1,1,0,0,0,0|2,0,0]=4 526 B8R0.8 C/C=C\C[C@H](N)C(=O)O CNP0134361.2 [1,1,0,0,0,0|2,0,0]=4 527 B8R0.8 C=C=CC[C@H](N)C(=O)O CNP0263596.1 [1,1,0,0,0,0|2,0,0]=4 528 B8R0.8 C=CSC[C@H](N)C(=O)O CNP0135574.1 [1,1,0,0,0,0|2,0,0]=4 529 B8R0.8 CCCC[C@H](O)C(=O)O CNP0296365.1 [1,1,0,0,0,0|1,0,1]=4 530 B8R0.8 CO/C=C/[C@H](N)C(=O)O CNP0277704.1 [1,1,0,0,0,0|1,0,1]=4 531 B8R0.8 CO/C=C\[C@H](N)C(=O)O CNP0277704.2 [1,1,0,0,0,0|1,0,1]=4 532 B8R0.8 CSCCC(O)C(=O)O CNP0398053.0 [1,1,0,0,0,0|0,1,1]=4 533 B8R0.8 C[C@H](NCCO)C(=O)O CNP0270315.1 [1,1,0,0,0,0|1,0,1]=4 534 B8R0.8 C[C@H](O)[C@@H](O)CCC=O CNP0343668.1 [1,1,0,0,0,0|1,0,1]=4 535 B8R0.8 NCCC[C@@H](O)C(=O)O CNP0154820.1 [1,1,0,0,0,0|1,0,1]=4 536 B8R0.8 NOCC[C@@H](N)C(=O)O CNP0325208.1 [1,1,0,0,0,0|1,0,1]=4 537 B8R0.8 NOCC[C@H](N)C(=O)O CNP0325208.2 [1,1,0,0,0,0|1,0,1]=4 538 B8R0.8 N[C@@H](C/C=C/Cl)C(=O)O CNP0123957.2 [1,1,0,0,0,0|2,0,0]=4 539 B8R0.8 N[C@@H](C/C=C\Cl)C(=O)O CNP0123957.1 [1,1,0,0,0,0|2,0,0]=4 540 B8R0.8 N[C@@H](CCC=O)C(=O)O CNP0085564.1 [1,1,0,0,0,0|1,0,0]=3 541 B8R0.8 N[C@@H](CCCO)C(=O)O CNP0218644.1 [1,1,0,0,0,0|1,0,1]=4 542 B8R0.8 N[C@@H](CS[AsH]O)C(=O)O CNP0489303.1 [1,1,0,0,0,0|2,0,0]=4 543 B8R0.8 N[C@H](CCCO)C(=O)O CNP0218644.2 [1,1,0,0,0,0|1,0,1]=4 544 B8R0.12 C=CCC(C)(N)C(=O)O CNP0555901.0 [1,1,0,0,0,0|2,0,0]=4 545 B8R0.12 O=C(O)C(O)(O)CCO CNP0527367.0 [1,1,0,0,0,0|0,0,1]=3 546 B8R0.15 C=CC[C@@H](NC)C(=O)O CNP0302571.1 [1,1,0,0,0,0|2,0,0]=4 547 B8R0.9 C=CC(=O)NCC(=O)O CNP0077507.0 [1,1,0,0,0,0|2,0,0]=4 548 B8R0.9 CC(=NO)CCC(=O)O CNP0136603.0 [1,1,0,0,0,0|1,0,0]=3 549 B8R0.9 CC=C(N)CCC(=O)O CNP0563504.0 [1,1,0,0,0,0|2,0,0]=4 550 B8R0.9 CCC(=O)CCC(=O)C CNP0351129.0 [1,1,0,0,0,0|2,0,0]=4 551 B8R0.9 CCC(=O)CCC(=O)O CNP0609090.0 [1,1,0,0,0,0|1,0,0]=3 552 B8R0.9 CCC(=O)NCC(=O)O CNP0322949.0 [1,1,0,0,0,0|2,0,0]=4 553 B8R0.9 COC(=O)C=CC(=O)O CNP0273242.0 [1,1,0,0,0,0|0,0,2]=4 554 B8R0.9 COC(=O)CCC(=O)C CNP0333853.0 [1,1,0,0,0,0|1,0,0]=3 555 B8R0.9 COC(=O)CCC(=O)N CNP0319465.0 [1,1,0,0,0,0|1,0,0]=3 556 B8R0.9 COC(=O)CCC(=O)O CNP0184181.0 [1,1,0,0,0,0|0,0,0]=2 557 B8R0.9 COC(=O)CNC(=O)C CNP0234479.0 [1,1,0,0,0,0|2,0,0]=4 558 B8R0.9 NCC(=O)CCC(=O)O CNP0153451.0 [1,1,0,0,0,0|1,0,0]=3 559 B8R0.9 NCC(=O)NCC(=O)O CNP0355149.0 [1,1,0,0,0,0|2,0,0]=4 560 B8R0.9 NC[C@@H](O)CCC(=O)O CNP0204037.1 [1,1,0,0,0,0|1,0,1]=4 561 B8R0.9 N[C@H](C=O)CCC(=O)O CNP0108280.1 [1,1,0,0,0,0|1,0,1]=4 562 B8R0.9 O=C(O)CCC(=O)CO CNP0325230.0 [1,1,0,0,0,0|0,0,0]=2 563 B8R0.9 O=C(O)CCC(=O)NO CNP0136196.0 [1,1,0,0,0,0|0,0,0]=2 564 B8R0.9 O=C(O)CC[C@H](O)CO CNP0251950.1 [1,1,0,0,0,0|0,0,2]=4 565 B8R0.9 O=CC(=O)CCC(=O)O CNP0115864.0 [1,1,0,0,0,0|0,0,1]=3 566 B8R0.29 CS(=O)(=O)CCC(=O)O CNP0352253.0 [1,1,0,0,0,0|1,0,1]=4 567 B8R0.29 O=C(O)CCP(=O)(O)O CNP0502443.0 [1,1,0,0,0,0|1,0,0]=3 568 B8R0.29 O=C(O)CCS(=O)(=O)O CNP0551286.0 [1,1,0,0,0,0|1,0,0]=3 569 B8R0.29 O=C(O)COP(=O)(O)O CNP0359504.0 [1,1,0,0,0,0|2,0,0]=4 570 B8R0.18 CCC(C(=O)C)C(=O)O CNP0082085.0 [0,1,0,0,1,0|2,0,0]=4 571 B8R0.18 CCC(C(=O)O)C(=O)O CNP0415777.0 [0,1,0,0,1,0|1,0,0]=3 572 B8R0.18 COC(C(=O)O)C(=O)O CNP0332418.0 [0,1,0,0,1,0|0,0,0]=2 573 B8R0.18 C[C@@H](O)[C@H](NO)C(=O)O CNP0541034.1 [0,1,0,0,1,0|1,0,1]=4 574 B8R0.27 CC(C)(O)[C@@H](O)C(=O)O CNP0224141.1 [0,1,0,0,1,0|1,0,1]=4 575 B8R0.27 CC(C)(O)[C@H](O)C(=O)O CNP0224141.2 [0,1,0,0,1,0|1,0,1]=4 576 B8R0.37 CC(=O)[C@](C)(O)C(=O)O CNP0358968.1 [0,1,0,0,1,0|1,0,0]=3 577 B8R0.37 CC(C)(C(=O)O)C(=O)O CNP0082122.0 [0,1,0,0,1,0|1,0,0]=3 578 B8R0.37 CC(O)(C(=O)O)C(=O)O CNP0101764.0 [0,1,0,0,1,0|0,0,0]=2 579 B8R0.37 C[C@@H](O)[C@](C)(O)C(=O)O CNP0265434.2 [0,1,0,0,1,0|1,0,1]=4 580 B8R0.37 C[C@H](O)[C@@](C)(O)C(=O)O CNP0265434.3 [0,1,0,0,1,0|1,0,1]=4 581 B8R0.37 C[C@H](O)[C@](C)(O)C(=O)O CNP0265434.1 [0,1,0,0,1,0|1,0,1]=4 582 B8R0.37 O=C(O)C(O)(O)C(=O)O CNP0083986.0 [0,1,0,0,1,0|0,0,0]=2 583 B10R0.12 CC(=O)NC[C@@H](O)P(=O)(O)O CNP0147948.1 [0,1,0,0,0,1|2,0,0]=4 584 B10R0.13 C=C(CC(=O)O)C(=C)C(=O)O CNP0084078.0 [0,1,0,0,0,1|1,0,1]=4 585 B10R0.13 C[C@@H](CC(=O)O)[C@H](N)C(=O)O CNP0480890.2 [0,1,0,0,0,1|1,0,0]=3 586 B10R0.13 C[C@H](CC(=O)O)[C@H](N)C(=O)O CNP0480890.1 [0,1,0,0,0,1|1,0,0]=3 587 B10R0.13 N[C@@H](C(=O)O)[C@@H](O)CC(=O)O CNP0241087.3 [0,1,0,0,0,1|1,0,0]=3 588 B10R0.13 N[C@@H](C(=O)O)[C@H](O)CC(=O)O CNP0241087.4 [0,1,0,0,0,1|1,0,0]=3 589 B10R0.13 N[C@@H](CC(=O)O)[C@@H](O)C(=O)O CNP0197187.2 [0,1,0,0,0,1|0,0,0]=2 590 B10R0.13 N[C@@H](CC(=O)O)[C@H](O)C(=O)O CNP0197187.3 [0,1,0,0,0,1|0,0,0]=2 591 B10R0.13 N[C@H](C(=O)O)/C(=C/C(=O)O)/Cl CNP0330028.1 [0,1,0,0,0,1|1,0,1]=4 592 B10R0.13 N[C@H](C(=O)O)[C@@H](O)CC(=O)O CNP0241087.1 [0,1,0,0,0,1|1,0,0]=3 593 B10R0.13 N[C@H](C(=O)O)[C@H](O)CC(=O)O CNP0241087.2 [0,1,0,0,0,1|1,0,0]=3 594 B10R0.13 N[C@H](CC(=O)O)[C@@H](O)C(=O)O CNP0197187.1 [0,1,0,0,0,1|0,0,0]=2 595 B10R0.43 CC(=O)CCC(N)(N)C(=O)O CNP0518279.0 [0,1,0,0,0,1|2,0,0]=4 596 B10R0.43 CC(C)(CCC(=O)O)C(=O)O CNP0440042.0 [0,1,0,0,0,1|1,0,0]=3 597 B10R0.57 CCC(O)C(O)CCC(=O)O CNP0552355.0 [0,1,0,0,0,1|1,0,1]=4 598 B10R0.57 COC(=O)C(N)CCC(=O)O CNP0082233.0 [0,1,0,0,0,1|1,0,0]=3 599 B10R0.57 COC(=O)[C@H](N)CCC(=O)N CNP0111984.1 [0,1,0,0,0,1|2,0,0]=4 600 B10R0.82 C/C(=C/C[C@H](N)C(=O)O)/CO CNP0153895.1 [0,1,0,0,0,1|2,0,0]=4 601 B10R0.82 C/C(=C\C[C@H](N)C(=O)O)/CO CNP0153895.2 [0,1,0,0,0,1|2,0,0]=4 602 B10R0.82 CC(=O)C(O)CC=C(C)C=O CNP0293417.0 [0,1,0,0,0,1|2,0,0]=4 603 B10R0.82 CNC(=O)CC[C@H](N)C(=O)O CNP0587641.1 [0,1,0,0,0,1|2,0,0]=4 604 B10R0.82 N/C(=N\C[C@H](N)C(=O)O)/NO CNP0536317.1 [0,1,0,0,0,1|2,0,0]=4 605 B10R0.82 NC(CCP(=O)CO)C(=O)O CNP0023391.0 [0,1,0,0,0,1|2,0,0]=4 606 B10R0.82 N[C@@H](C/C=C(\Cl)/CO)C(=O)O CNP0102799.1 [0,1,0,0,0,1|2,0,0]=4 607 B10R0.82 N[C@@H](CCC(=O)NO)C(=O)O CNP0481563.1 [0,1,0,0,0,1|1,0,0]=3 608 B10R0.82 N[C@@H](CCN(O)N=O)C(=O)O CNP0335833.1 [0,1,0,0,0,1|2,0,0]=4 609 B10R0.82 N[C@@H](CNC(=O)NO)C(=O)O CNP0208137.1 [0,1,0,0,0,1|1,0,0]=3 610 B10R0.82 N[C@H](CCN(O)N=O)C(=O)O CNP0335833.2 [0,1,0,0,0,1|2,0,0]=4 611 B10R0.84 CC(=O)SC[C@@H](CS)C(=O)O CNP0123477.1 [0,1,0,0,0,1|1,1,0]=4 612 B10R0.84 CCC(CCC(=O)O)C(=O)O CNP0084072.0 [0,1,0,0,0,1|1,0,0]=3 613 B10R0.84 CNC(CCC(=O)C)C(=O)O CNP0217450.0 [0,1,0,0,0,1|2,0,0]=4 614 B10R0.84 CN[C@@H](CCC(=O)O)C(=O)O CNP0330606.1 [0,1,0,0,0,1|1,0,0]=3 615 B10R0.84 CN[C@H](CCC(=O)O)C(=O)O CNP0330606.2 [0,1,0,0,0,1|1,0,0]=3 616 B10R0.84 O=C(O)CCC(=NO)C(=O)O CNP0033783.0 [0,1,0,0,0,1|0,0,1]=3 617 B10R0.92 CC(=O)C(O)COP(=O)(O)O CNP0083435.0 [0,1,0,0,0,1|2,0,0]=4 618 B10R0.92 CP(=O)(O)CC[C@@H](N)C(=O)O CNP0251316.1 [0,1,0,0,0,1|2,0,0]=4 619 B10R0.92 CP(=O)(O)CC[C@H](N)C(=O)O CNP0251316.3 [0,1,0,0,0,1|2,0,0]=4 620 B10R0.92 C[As](=O)(O)CCC(N)C(=O)O CNP0531933.0 [0,1,0,0,0,1|2,0,0]=4 621 B10R0.92 C[P@@](=O)(O)CC[C@@H](N)C(=O)O CNP0251316.2 [0,1,0,0,0,1|2,0,0]=4 622 B10R0.92 C[P@@](=O)(O)CC[C@H](N)C(=O)O CNP0251316.5 [0,1,0,0,0,1|2,0,0]=4 623 B10R0.92 C[P@](=O)(O)CC[C@@H](N)C(=O)O CNP0251316.4 [0,1,0,0,0,1|2,0,0]=4 624 B10R0.92 N[C@@H](CCS(=O)(=O)O)C(=O)O CNP0112379.1 [0,1,0,0,0,1|2,0,0]=4 625 B10R0.92 N[C@@H](COP(=O)(O)O)C(=O)O CNP0263057.1 [0,1,0,0,0,1|2,0,0]=4 626 B10R0.92 N[C@@H](COS(=O)(=O)O)C(=O)O CNP0454767.1 [0,1,0,0,0,1|2,0,0]=4 627 B10R0.92 N[C@@H](CSP(=O)(O)O)C(=O)O CNP0547026.1 [0,1,0,0,0,1|2,0,0]=4 628 B10R0.92 N[C@@H](CSS(=O)(=O)O)C(=O)O CNP0272393.1 [0,1,0,0,0,1|2,0,0]=4 629 B10R0.92 N[C@@H](CS[As](=O)(O)O)C(=O)O CNP0547553.1 [0,1,0,0,0,1|2,0,0]=4 630 B10R0.92 N[C@H](CCS(=O)(=O)O)C(=O)O CNP0112379.2 [0,1,0,0,0,1|2,0,0]=4 631 B10R0.92 N[C@H](COP(=O)(O)O)C(=O)O CNP0263057.2 [0,1,0,0,0,1|2,0,0]=4 632 B10R0.92 O=C(O)[C@@H](O)COP(=O)(O)O CNP0302270.2 [0,1,0,0,0,1|1,0,0]=3 633 B10R0.92 O=C(O)[C@H](O)COP(=O)(O)O CNP0302270.1 [0,1,0,0,0,1|1,0,0]=3 634 B10R0.93 C=C(CC(=O)C(=O)O)C(=O)O CNP0158198.0 [0,1,0,0,0,1|0,0,2]=4 635 B10R0.93 C=C(C[C@@H](N)C(=O)O)C(=O)O CNP0294348.1 [0,1,0,0,0,1|1,0,0]=3 636 B10R0.93 C=C(C[C@H](N)C(=O)O)C(=O)N CNP0305831.1 [0,1,0,0,0,1|2,0,0]=4 637 B10R0.93 C=C(C[C@H](N)C(=O)O)C(=O)O CNP0294348.2 [0,1,0,0,0,1|1,0,0]=3 638 B10R0.93 C=C(Cl)C(O)C[C@H](N)C(=O)O CNP0524845.1 [0,1,0,0,0,1|2,0,0]=4 639 B10R0.93 CC(CC(C)C(=O)O)C(=O)O CNP0258872.0 [0,1,0,0,0,1|1,0,0]=3 640 B10R0.93 CC(C[C@H](N)C(=O)O)C(=O)O CNP0104947.4 [0,1,0,0,0,1|1,0,0]=3 641 B10R0.93 C[C@@H](CC(=O)C(=O)O)C(=O)O CNP0239723.1 [0,1,0,0,0,1|1,0,0]=3 642 B10R0.93 C[C@@H](C[C@@H](N)C(=O)O)C(=O)O CNP0104947.2 [0,1,0,0,0,1|1,0,0]=3 643 B10R0.93 C[C@@H](C[C@H](N)C(=O)O)C(=O)O CNP0104947.3 [0,1,0,0,0,1|1,0,0]=3 644 B10R0.93 C[C@H](CC(=O)C(=O)O)C(=O)O CNP0239723.2 [0,1,0,0,0,1|1,0,0]=3 645 B10R0.93 C[C@H](C[C@H](N)C(=O)O)C(=O)O CNP0104947.1 [0,1,0,0,0,1|1,0,0]=3 646 B10R0.93 C[C@H](N[C@@H](C)C(=O)O)C(=O)O CNP0113352.1 [0,1,0,0,0,1|1,0,0]=3 647 B10R0.93 C[C@H](O)[C@H](O)CC(=O)C(=O)O CNP0445081.1 [0,1,0,0,0,1|1,0,1]=4 648 B10R0.93 C[C@H](O[C@H](C)C(=O)O)C(=O)O CNP0324289.1 [0,1,0,0,0,1|1,0,0]=3 649 B10R0.93 NC(=O)[C@H](O)C[C@H](N)C(=O)O CNP0558054.1 [0,1,0,0,0,1|1,0,0]=3 650 B10R0.93 N[C@@H](CC(O)C(=O)O)C(=O)O CNP0200662.3 [0,1,0,0,0,1|0,0,0]=2 651 B10R0.93 N[C@@H](C[C@@H](O)C(=O)O)C(=O)O CNP0200662.2 [0,1,0,0,0,1|0,0,0]=2 652 B10R0.93 N[C@@H](C[C@H](O)C(=O)O)C(=O)O CNP0200662.1 [0,1,0,0,0,1|0,0,0]=2 653 B10R0.93 N[C@H](C[C@@H](O)C(=O)O)C(=O)O CNP0200662.4 [0,1,0,0,0,1|0,0,0]=2 654 B10R0.93 O=C(O)C(=O)CC(O)C(=O)O CNP0002358.0 [0,1,0,0,0,1|0,0,0]=2 655 B10R0.44 COC(=O)CC(=CC(=O)O)C CNP0155596.0 [0,1,0,0,0,1|1,0,1]=4 656 B10R0.44 C[C@H](CC(=O)O)OC(=O)CO CNP0592868.1 [0,1,0,0,0,1|1,0,0]=3 657 B10R0.70 CNC(CC(=O)O)CC(=O)O CNP0261205.0 [0,1,0,0,0,1|1,0,0]=3 658 B10R0.70 O=C(O)CC(CO)CC(=O)O CNP0157027.0 [0,1,0,0,0,1|0,0,0]=2 659 B10R0.165 CC(C)(CC(=O)O)CC(=O)O CNP0057490.0 [0,1,0,0,0,1|1,0,0]=3 660 B10R0.165 CC(O)(CC(=O)O)CC(=O)O CNP0185364.0 [0,1,0,0,0,1|0,0,0]=2 661 B10R0.47 COC(=O)CC(C)(O)C(=O)O CNP0132796.0 [0,2,0,0,0,0|0,0,0]=2 662 B10R0.47 COC(=O)C[C@@](C)(O)C(=O)O CNP0132796.1 [0,2,0,0,0,0|0,0,0]=2 663 B10R0.117 CC(C(=O)O)C(C)(O)C(=O)O CNP0473267.0 [0,2,0,0,0,0|0,0,0]=2 664 B10R0.119 CCC(O)(CC(=O)O)C(=O)O CNP0084088.0 [0,2,0,0,0,0|0,0,0]=2 665 B10R0.119 CC[C@@](C)(CC(=O)O)C(=O)O CNP0444199.1 [0,2,0,0,0,0|1,0,0]=3 666 B10R0.119 CC[C@](C)(CC(=O)O)C(=O)O CNP0444199.2 [0,2,0,0,0,0|1,0,0]=3 667 B10R0.119 O=C(O)CC(O)(CP)C(=O)O CNP0533279.0 [0,2,0,0,0,0|0,0,0]=2 668 B10R0.119 O=C(O)C[C@@](O)(CO)C(=O)O CNP0105674.1 [0,2,0,0,0,0|0,0,0]=2 669 B10R0.141 COC(=O)C(C)(O)CC(=O)O CNP0132793.0 [0,2,0,0,0,0|0,0,0]=2 670 B10R0.141 COC(=O)[C@](C)(O)CC(=O)O CNP0132793.1 [0,2,0,0,0,0|0,0,0]=2 671 B10R0.46 C=C(CC(=O)OC)C(=O)OC CNP0185173.0 [0,2,0,0,0,0|1,0,1]=4 672 B10R0.46 COC(=O)CC(=O)C(=O)OC CNP0261519.0 [0,2,0,0,0,0|0,0,2]=4 673 B10R0.46 COC(=O)C[C@@H](O)C(=O)OC CNP0140271.1 [0,2,0,0,0,0|0,0,0]=2 674 B10R0.46 COC(=O)C[C@H](N)C(=O)OC CNP0177660.1 [0,2,0,0,0,0|1,0,0]=3 675 B10R0.46 COC(=O)C[C@H](O)C(=O)OC CNP0140271.2 [0,2,0,0,0,0|0,0,0]=2 676 B10R0.54 COC(=O)[C@H](CC(=O)C)OC CNP0311272.1 [0,2,0,0,0,0|1,0,0]=3 677 B10R0.56 COC(=O)[C@H](O)[C@H](N)C(=O)O CNP0156686.1 [0,2,0,0,0,0|0,0,0]=2 678 B10R0.56 C[C@H](O)[C@@H](O)[C@@H](O)C(=O)CO CNP0085554.1 [0,2,0,0,0,0|1,0,1]=4 679 B10R0.56 C[C@H](O)[C@@H](O)[C@H](O)C(=O)CO CNP0085554.3 [0,2,0,0,0,0|1,0,1]=4 680 B10R0.56 C[C@H](O)[C@H](O)[C@@H](O)C(=O)CO CNP0085554.2 [0,2,0,0,0,0|1,0,1]=4 681 B10R0.56 N[C@@H](C(=O)O)[C@@H](O)[C@H](O)CO CNP0245634.1 [0,2,0,0,0,0|0,0,2]=4 682 B10R0.56 O=C(O)[C@@H](O)[C@@H](O)[C@@H](O)CO CNP0348844.3 [0,2,0,0,0,0|0,0,2]=4 683 B10R0.56 O=C(O)[C@@H](O)[C@@H](O)[C@H](O)CO CNP0348844.4 [0,2,0,0,0,0|0,0,2]=4 684 B10R0.56 O=C(O)[C@@H](O)[C@H](O)[C@@H](O)CO CNP0348844.5 [0,2,0,0,0,0|0,0,2]=4 685 B10R0.56 O=C(O)[C@@H](O)[C@H](O)[C@H](O)CO CNP0348844.1 [0,2,0,0,0,0|0,0,2]=4 686 B10R0.56 O=C(O)[C@H](O)[C@@H](O)[C@@H](O)CO CNP0348844.7 [0,2,0,0,0,0|0,0,2]=4 687 B10R0.56 O=C(O)[C@H](O)[C@@H](O)[C@H](O)CO CNP0348844.6 [0,2,0,0,0,0|0,0,2]=4 688 B10R0.56 O=C(O)[C@H](O)[C@H](O)[C@H](O)CO CNP0348844.2 [0,2,0,0,0,0|0,0,2]=4 689 B10R0.56 O=C[C@H](O)[C@@H](O)[C@H](O)C(=O)O CNP0231081.1 [0,2,0,0,0,0|0,0,1]=3 690 B10R0.56 O=C[C@H](O)[C@H](O)[C@@H](O)C(=O)O CNP0231081.2 [0,2,0,0,0,0|0,0,1]=3 691 B10R0.23 CCC=C(CC(=O)O)C(=O)O CNP0526667.0 [0,2,0,0,0,0|1,0,1]=4 692 B10R0.23 CCC[C@@H](CC(=O)O)C(=O)O CNP0297419.1 [0,2,0,0,0,0|1,0,0]=3 693 B10R0.23 N=CN[C@@H](CC(=O)O)C(=O)O CNP0474921.1 [0,2,0,0,0,0|1,0,0]=3 694 B10R0.23 O=CN[C@@H](CC(=O)O)C(=O)O CNP0207803.1 [0,2,0,0,0,0|0,0,1]=3 695 B10R0.53 NCC(=O)N[C@@H](CO)C(=O)O CNP0381639.1 [0,2,0,0,0,0|2,0,0]=4 696 B10R0.53 NCC(=O)N[C@H](CO)C(=O)O CNP0381639.2 [0,2,0,0,0,0|2,0,0]=4 697 B10R0.76 C=C(C(=O)O)C(CC)C(=O)O CNP0355355.0 [0,2,0,0,0,0|1,0,1]=4 698 B10R0.76 CCC(C(=O)O)C(C)C(=O)O CNP0104338.0 [0,2,0,0,0,0|1,0,0]=3 699 B10R0.76 CC[C@@H](C(=O)O)[C@H](O)C(=O)O CNP0155483.1 [0,2,0,0,0,0|0,0,0]=2 700 B10R0.76 O=C[C@@H](C(=O)O)[C@@H](O)C(=O)O CNP0145834.1 [0,2,0,0,0,0|0,0,0]=2 701 B10R0.95 O=C(O)[C@@H](CO)OP(=O)(O)O CNP0190729.1 [0,2,0,0,0,0|2,0,0]=4 702 B10R0.162 CC(=C(CC(=O)O)C(=O)O)C CNP0009898.0 [0,2,0,0,0,0|1,0,1]=4 703 B10R0.162 CC(=O)OC(C(=O)O)C(=O)O CNP0253612.0 [0,2,0,0,0,0|2,0,0]=4 704 B10R0.26 C/C(=C\CO)/C[C@H](N)C(=O)O CNP0197260.1 [0,2,0,0,0,0|2,0,0]=4 705 B10R0.26 CCOC(=O)CC(C)C(=O)O CNP0119918.0 [0,2,0,0,0,0|1,0,0]=3 706 B10R0.26 CCOC(=O)C[C@@H](O)C(=O)O CNP0340887.1 [0,2,0,0,0,0|0,0,0]=2 707 B10R0.26 NCCC(=O)C[C@H](N)C(=O)O CNP0253438.1 [0,2,0,0,0,0|2,0,0]=4 708 B8R1.18 C=C1CC(=O)OC1=O CNP0331229.0 [1,0,0,1,0,0|1,0,1]=4 709 B8R1.18 CC1CC(=O)OC1=O CNP0605808.0 [1,0,0,1,0,0|1,0,0]=3 710 B8R1.18 C[C@@H]1CC(=O)O[C@@H]1O CNP0514766.1 [1,0,0,1,0,0|1,0,1]=4 711 B8R1.18 C[C@@H]1C[C@@H](C(=O)O1)O CNP0321716.1 [1,0,0,1,0,0|1,0,1]=4 712 B8R1.18 N[C@H]1CC(=NC1=O)O CNP0547407.1 [1,0,0,1,0,0|2,0,0]=4 713 B8R1.18 O=C1NC(=O)[C@@H](N1)O CNP0248349.1 [1,0,0,1,0,0|2,0,0]=4 714 B8R1.20 C=C1C[C@H]1CC(=O)O CNP0279840.1 [1,0,0,1,0,0|2,0,0]=4 715 B8R1.31 N[C@H]1CO[C@H]1C(=O)O CNP0307308.1 [1,0,0,1,0,0|1,0,1]=4 716 B8R1.7 CC(=O)C1CC=CO1 CNP0077183.0 [1,0,0,1,0,0|2,0,0]=4 717 B8R1.7 O=C(O)C1CC=CN1 CNP0535760.0 [1,0,0,1,0,0|2,0,0]=4 718 B8R1.7 O=C(O)[C@H]1CCCO1 CNP0573832.1 [1,0,0,1,0,0|1,0,1]=4 719 B8R1.3 O=C1C=CC(=O)CC1 CNP0076081.0 [1,0,0,1,0,0|2,0,0]=4 720 B8R1.3 O=C1CCC(=O)CC1 CNP0521419.0 [1,0,0,1,0,0|2,0,0]=4 721 B8R1.3 O=C1CCC(=O)OC1 CNP0357956.0 [1,0,0,1,0,0|1,0,0]=3 722 B8R1.50 O=C1OCC(=C1O)O CNP0612147.0 [0,0,0,1,1,0|1,0,1]=4 723 B8R1.50 O=C1OC[C@@H]([C@@H]1O)O CNP0228474.4 [0,0,0,1,1,0|1,0,1]=4 724 B8R1.50 O=C1OC[C@@H]([C@H]1O)O CNP0228474.2 [0,0,0,1,1,0|1,0,1]=4 725 B8R1.50 O=C1OC[C@H]([C@@H]1O)O CNP0228474.1 [0,0,0,1,1,0|1,0,1]=4 726 B8R1.50 O=C1OC[C@H]([C@H]1O)O CNP0228474.3 [0,0,0,1,1,0|1,0,1]=4 727 B10R1.58 O=C(O)[C@@H]1CC(C(=N1)O)O CNP0540839.1 [0,0,0,1,0,1|1,0,0]=3 728 B10R1.58 O=C1N[C@@H](CC1O)C(=O)O CNP0608855.1 [0,0,0,1,0,1|1,0,0]=3 729 B10R1.332 O=C1CCC(C(CO1)O)O CNP0245181.0 [0,0,0,1,0,1|1,0,1]=4 730 B10R1.349 O=C(O)C1CC(C1)C(=O)O CNP0560899.0 [0,0,0,1,0,1|1,0,0]=3 731 B10R1.470 C[C@@]1(CCC(=O)N1)C(=O)O CNP0493545.2 [0,0,0,1,0,1|2,0,0]=4 732 B10R1.470 C[C@]1(CCC(=O)N1)C(=O)O CNP0493545.1 [0,0,0,1,0,1|2,0,0]=4 733 B10R1.470 O=C1C=CC(O1)(O)C(=O)O CNP0527399.0 [0,0,0,1,0,1|0,0,1]=3 734 B10R1.470 O=C1CCC(O1)(O)C(=O)O CNP0581188.0 [0,0,0,1,0,1|0,0,0]=2 735 B10R1.470 O=C1C[C@](CO1)(O)C(=O)O CNP0159921.1 [0,0,0,1,0,1|1,0,0]=3 736 B10R1.54 O=C(O)CC1CCC(=O)O1 CNP0554238.0 [0,0,0,1,0,1|2,0,0]=4 737 B10R1.54 O=C(O)C[C@@H]1C=CC(=O)O1 CNP0273929.2 [0,0,0,1,0,1|2,0,0]=4 738 B10R1.54 O=C(O)C[C@H]1C=CC(=O)O1 CNP0273929.1 [0,0,0,1,0,1|2,0,0]=4 739 B10R1.54 O=C(O)C[C@H]1COC(=O)C1 CNP0303223.1 [0,0,0,1,0,1|1,0,0]=3 740 B10R1.282 C=C1[C@H]([C@@H]1C(=O)O)C(=O)O CNP0173843.1 [0,0,0,1,0,1|1,0,1]=4 741 B10R1.330 O=C1CCC(=O)CC(C1)O CNP0144196.0 [0,0,0,1,0,1|2,0,0]=4 742 B10R1.64 O=C(O)CC1NC=NC1=O CNP0059648.0 [0,1,0,1,0,0|2,0,0]=4 743 B10R1.194 CC(=O)[C@@H]1COC(=O)[C@H]1C CNP0176461.1 [0,1,0,1,0,0|2,0,0]=4 744 B10R1.194 CC1C(=O)CC[C@H]1C(=O)O CNP0156871.3 [0,1,0,1,0,0|2,0,0]=4 745 B10R1.194 C[C@@H]1C(=O)CC[C@@H]1C(=O)O CNP0156871.2 [0,1,0,1,0,0|2,0,0]=4 746 B10R1.194 C[C@@H]1C(=O)CC[C@H]1C(=O)O CNP0156871.1 [0,1,0,1,0,0|2,0,0]=4 747 B10R1.194 C[C@H]1C(=O)CC[C@@H]1C(=O)O CNP0156871.4 [0,1,0,1,0,0|2,0,0]=4 748 B10R1.194 C[C@H]1C(=O)OC[C@@H]1C(=O)O CNP0122387.1 [0,1,0,1,0,0|1,0,0]=3 749 B10R1.194 O=C(O)[C@@H]1NC[C@H]([C@H]1O)O CNP0331184.2 [0,1,0,1,0,0|1,0,1]=4 750 B10R1.194 O=C(O)[C@H]1NC[C@@H]([C@H]1O)O CNP0331184.4 [0,1,0,1,0,0|1,0,1]=4 751 B10R1.194 O=C(O)[C@H]1NC[C@H]([C@@H]1O)O CNP0331184.1 [0,1,0,1,0,0|1,0,1]=4 752 B10R1.194 O=C(O)[C@H]1NC[C@H]([C@H]1O)O CNP0331184.3 [0,1,0,1,0,0|1,0,1]=4 753 B10R1.113 O=C1CCCC(C1)C(=O)O CNP0612018.0 [0,1,0,1,0,0|2,0,0]=4 754 B10R1.113 O=C1CCN[C@@H](C1)C(=O)O CNP0137744.1 [0,1,0,1,0,0|2,0,0]=4 755 B10R1.119 O=C1OC[C@H]([C@@H]([C@H]1O)O)O CNP0214480.1 [0,1,0,1,0,0|1,0,1]=4 756 B8R0.28 CC(=O)CCCC(=O)C CNP0084433.0 [1,0,0,0,0,1|2,0,0]=4 757 B8R0.28 CC(=O)CCCC(=O)O CNP0456571.0 [1,0,0,0,0,1|1,0,0]=3 758 B8R0.28 CC(=O)CCOC(=O)C CNP0480131.0 [1,0,0,0,0,1|2,0,0]=4 759 B8R0.28 CC(=O)NCCC(=O)O CNP0454986.0 [1,0,0,0,0,1|1,0,0]=3 760 B8R0.28 C[C@@H](O)CCCC(=O)O CNP0082052.1 [1,0,0,0,0,1|1,0,1]=4 761 B8R0.28 N=C(N)NCCC(=O)O CNP0480617.0 [1,0,0,0,0,1|2,0,0]=4 762 B8R0.28 NC(=NCCC(=O)O)N CNP0139818.0 [1,0,0,0,0,1|2,0,0]=4 763 B8R0.28 NC(=O)CCCC(=O)N CNP0251512.0 [1,0,0,0,0,1|2,0,0]=4 764 B8R0.28 NC(=O)NCCC(=O)O CNP0350035.0 [1,0,0,0,0,1|1,0,0]=3 765 B8R0.28 NC(=O)NCNC(=O)O CNP0206621.0 [1,0,0,0,0,1|2,0,0]=4 766 B8R0.28 O=C(O)C=CCC(=O)O CNP0111503.0 [1,0,0,0,0,1|0,0,1]=3 767 B8R0.28 O=C(O)CCCC(=O)O CNP0256820.0 [1,0,0,0,0,1|0,0,0]=2 768 B8R0.28 O=C(O)CCO[N+](=O)[O-] CNP0488226.0 [1,0,0,0,0,1|1,0,1]=4 769 B8R0.28 O=C(O)CNCC(=O)O CNP0080016.0 [1,0,0,0,0,1|0,0,0]=2 770 B8R0.28 O=C(O)COCC(=O)O CNP0463298.0 [1,0,0,0,0,1|0,0,0]=2 771 B8R0.28 O=C(O)CSCC(=O)O CNP0310100.0 [1,0,0,0,0,1|0,0,0]=2 772 B10R0.96 C[C@@H](CCC(=O)O)CC(=O)O CNP0259340.1 [0,0,0,0,0,2|1,0,0]=3 773 B10R0.96 C[C@H](CCC(=O)O)CC(=O)O CNP0259340.2 [0,0,0,0,0,2|1,0,0]=3 774 B10R0.96 N=C(N)NC[C@H](O)CC(=O)O CNP0326355.1 [0,0,0,0,0,2|2,0,0]=4 775 B10R0.96 NC(=O)CCC(N)CC(=O)O CNP0415823.0 [0,0,0,0,0,2|2,0,0]=4 776 B10R0.96 O=C(O)CCC(=O)CC(=O)O CNP0303700.0 [0,0,0,0,0,2|0,0,2]=4 777 B10R0.96 O=C(O)CCC(O)CC(=O)O CNP0084473.0 [0,0,0,0,0,2|0,0,0]=2 778 B10R0.98 CC(=O)CSC[C@H](N)C(=O)O CNP0525755.1 [0,0,0,0,0,2|2,0,0]=4 779 B10R0.98 CC(=O)NCCC(N)C(=O)O CNP0147930.0 [0,0,0,0,0,2|2,0,0]=4 780 B10R0.98 CC(=O)NCC[C@H](N)C(=O)O CNP0147930.1 [0,0,0,0,0,2|2,0,0]=4 781 B10R0.98 CC(=O)OCC[C@H](N)C(=O)O CNP0415355.1 [0,0,0,0,0,2|2,0,0]=4 782 B10R0.98 C[C@@H](NCCC(=O)O)C(=O)O CNP0294276.2 [0,0,0,0,0,2|1,0,0]=3 783 B10R0.98 C[C@H](NCCC(=O)O)C(=O)O CNP0294276.1 [0,0,0,0,0,2|1,0,0]=3 784 B10R0.98 NC(=O)C#CC[C@H](N)C(=O)O CNP0551971.1 [0,0,0,0,0,2|2,0,0]=4 785 B10R0.98 NC(=O)CCCC(N)C(=O)O CNP0609522.0 [0,0,0,0,0,2|2,0,0]=4 786 B10R0.98 NC(=O)CSC[C@H](N)C(=O)O CNP0535403.1 [0,0,0,0,0,2|2,0,0]=4 787 B10R0.98 NC(=O)NOC[C@@H](N)C(=O)O CNP0080862.2 [0,0,0,0,0,2|2,0,0]=4 788 B10R0.98 NC(=O)NOC[C@H](N)C(=O)O CNP0080862.1 [0,0,0,0,0,2|2,0,0]=4 789 B10R0.98 NC(CC#CC(=O)O)C(=O)O CNP0341360.0 [0,0,0,0,0,2|1,0,0]=3 790 B10R0.98 N[C@@H](CCCC(=O)O)C(=O)O CNP0180807.1 [0,0,0,0,0,2|1,0,0]=3 791 B10R0.98 N[C@@H](CCNC(=O)O)C(=O)O CNP0080256.1 [0,0,0,0,0,2|1,0,0]=3 792 B10R0.98 N[C@@H](CSCC(=O)O)C(=O)O CNP0238143.1 [0,0,0,0,0,2|1,0,0]=3 793 B10R0.98 N[C@H](C=C=CC(=O)O)C(=O)O CNP0215430.1 [0,0,0,0,0,2|1,0,1]=4 794 B10R0.98 N[C@H](CCCC(=O)O)C(=O)O CNP0180807.2 [0,0,0,0,0,2|1,0,0]=3 795 B10R0.98 O=C(O)C=CCC(=O)C(=O)O CNP0359492.0 [0,0,0,0,0,2|0,0,2]=4 796 B10R0.98 O=C(O)CCCC(=O)C(=O)O CNP0300956.0 [0,0,0,0,0,2|0,0,2]=4 797 B10R0.98 O=C(O)CCC[C@@H](O)C(=O)O CNP0094826.1 [0,0,0,0,0,2|0,0,0]=2