0 B8R0.37 CC(=O)[C@@](C)(O)[C@@H](C)O CNP0563769.1 [0,0,0,0,0,0|2,0,1]=3 1 B8R0.37 CC(=O)[C@](C)(O)[C@@H](C)O CNP0563769.2 [0,0,0,0,0,0|2,0,1]=3 2 B8R0.37 CC(C)C(C)(O)C(C)C CNP0002939.0 [0,0,0,0,0,0|0,0,0]=0 3 B8R0.37 CC(C)[C@@](N)(O)C(=O)O CNP0185848.1 [0,0,0,0,0,0|3,0,1]=4 4 B8R0.37 CC(C)[C@](N)(O)C(=O)O CNP0185848.2 [0,0,0,0,0,0|3,0,1]=4 5 B8R0.37 C[C@@H](O)C(C)(O)[C@@H](C)O CNP0171250.2 [0,0,0,0,0,0|2,0,0]=2 6 B8R0.37 C[C@@H](O)[C@](C)(O)C(=O)O CNP0265434.2 [0,0,0,0,0,0|3,0,1]=4 7 B8R0.37 C[C@H](O)C(C)(O)[C@H](C)O CNP0171250.1 [0,0,0,0,0,0|2,0,0]=2 8 B8R0.37 C[C@H](O)[C@@](C)(O)C(=O)O CNP0265434.3 [0,0,0,0,0,0|3,0,1]=4 9 B8R0.37 C[C@H](O)[C@@](C)(O)[C@@H](C)O CNP0171250.3 [0,0,0,0,0,0|2,0,0]=2 10 B8R0.37 C[C@H](O)[C@](C)(O)C(=O)O CNP0265434.1 [0,0,0,0,0,0|3,0,1]=4 11 B7R0.13 C=C[C@@](C)(O)C(C)C CNP0249096.1 [1,0,0,0,0,0|0,0,2]=3 12 B7R0.13 CCC(C)(C)C(C)C CNP0085046.0 [1,0,0,0,0,0|1,0,0]=2 13 B7R0.13 CC[C@@](C)(O)C(=O)N CNP0151624.1 [1,0,0,0,0,0|2,0,1]=4 14 B7R0.13 CC[C@@](C)(O)C(=O)O CNP0382124.1 [1,0,0,0,0,0|2,0,1]=4 15 B7R0.13 CC[C@](C)(O)C(=O)O CNP0382124.2 [1,0,0,0,0,0|2,0,1]=4 16 B7R0.13 C[C@@H](O)[C@@](C)(O)CN CNP0540004.1 [1,0,0,0,0,0|2,0,0]=3 17 B7R0.16 CC(=O)C(S)C(C)C CNP0012295.0 [1,0,0,0,0,0|1,1,1]=4 18 B7R0.16 CC(=O)N(C)C(C)C CNP0111110.0 [1,0,0,0,0,0|2,0,1]=4 19 B7R0.16 CC(=O)[C@@H](Br)C(C)C CNP0046833.1 [1,0,0,0,0,0|2,0,1]=4 20 B7R0.16 CC(=O)[C@H](Br)C(C)C CNP0046833.2 [1,0,0,0,0,0|2,0,1]=4 21 B7R0.16 CC(C)C(=O)C(C)C CNP0413157.0 [1,0,0,0,0,0|0,0,2]=3 22 B7R0.16 CC(C)C(=O)C(C)O CNP0291790.0 [1,0,0,0,0,0|1,0,2]=4 23 B7R0.16 CC(C)C(N)C(C)C CNP0083055.0 [1,0,0,0,0,0|1,0,0]=2 24 B7R0.16 CC(C)C(O)C(C)C CNP0366830.0 [1,0,0,0,0,0|0,0,0]=1 25 B7R0.16 CC(C)[C@@H](O)C(=O)N CNP0311908.1 [1,0,0,0,0,0|2,0,1]=4 26 B7R0.16 CC(C)[C@@H](O)C(=O)O CNP0267024.1 [1,0,0,0,0,0|2,0,1]=4 27 B7R0.16 CC(C)[C@H](O)C(=O)O CNP0267024.2 [1,0,0,0,0,0|2,0,1]=4 28 B9R1.238 CC1(C(C1(Cl)Cl)(C)C)C CNP0241413.0 [0,0,0,1,0,0|2,0,0]=3 29 B9R0.11 CC(C)[C@@](C)(O)CC(=O)O CNP0235534.2 [0,0,0,0,0,1|2,0,1]=4 30 B9R0.11 CC(C)[C@](C)(O)CC(=O)O CNP0235534.1 [0,0,0,0,0,1|2,0,1]=4 31 B6R0.3 C=C(C)[C@H](C)CC CNP0076705.1 [2,0,0,0,0,0|0,0,2]=4 32 B6R0.3 CC(C)C(C)CO CNP0127606.0 [2,0,0,0,0,0|1,0,0]=3 33 B6R0.3 CC(C)[C@@H](N)CO CNP0177308.2 [2,0,0,0,0,0|2,0,0]=4 34 B6R0.3 CC(C)[C@@H](O)C#N CNP0164289.1 [2,0,0,0,0,0|1,0,1]=4 35 B6R0.3 CC(C)[C@@H](S)CO CNP0191310.1 [2,0,0,0,0,0|1,1,0]=4 36 B6R0.3 CC(C)[C@H](N)CO CNP0177308.1 [2,0,0,0,0,0|2,0,0]=4 37 B6R0.3 CCC(=C(C)C)C CNP0076862.0 [2,0,0,0,0,0|0,0,2]=4 38 B6R0.3 CCC(=O)C(C)C CNP0169958.0 [2,0,0,0,0,0|0,0,2]=4 39 B6R0.3 CCC(O)C(=O)C CNP0413470.0 [2,0,0,0,0,0|1,0,1]=4 40 B6R0.3 CCC(O)C(C)C CNP0265736.0 [2,0,0,0,0,0|0,0,0]=2 41 B6R0.3 CCC(O)C(C)O CNP0519497.0 [2,0,0,0,0,0|1,0,0]=3 42 B6R0.3 CCC(S)C(C)C CNP0611989.0 [2,0,0,0,0,0|0,1,0]=3 43 B6R0.3 CC[C@@H](C)C(=O)C CNP0151175.1 [2,0,0,0,0,0|1,0,1]=4 44 B6R0.3 CC[C@@H](C)C(O)O CNP0597016.1 [2,0,0,0,0,0|2,0,0]=4 45 B6R0.3 CC[C@@H](C)[C@@H](C)O CNP0061619.1 [2,0,0,0,0,0|1,0,0]=3 46 B6R0.3 CC[C@@H](O)C(=O)C CNP0413470.1 [2,0,0,0,0,0|1,0,1]=4 47 B6R0.3 CC[C@H](C)C(=O)C CNP0151175.2 [2,0,0,0,0,0|1,0,1]=4 48 B6R0.3 CC[C@H](C)C(C)C CNP0304167.1 [2,0,0,0,0,0|0,0,0]=2 49 B6R0.3 CC[C@H](C)[C@@H](C)O CNP0061619.2 [2,0,0,0,0,0|1,0,0]=3 50 B6R0.3 CSC(C)C(C)C CNP0245218.0 [2,0,0,0,0,0|1,0,0]=3 51 B6R0.3 C[C@@H](O)[C@@H](C)CO CNP0424442.1 [2,0,0,0,0,0|2,0,0]=4 52 B6R0.3 C[C@@H](O)[C@@H](O)CO CNP0199934.3 [2,0,0,0,0,0|2,0,0]=4 53 B6R0.3 C[C@@H](O)[C@H](O)CO CNP0199934.1 [2,0,0,0,0,0|2,0,0]=4 54 B6R0.3 C[C@H](CCl)N(C)C CNP0239301.1 [2,0,0,0,0,0|2,0,0]=4 55 B6R0.3 C[C@H](O)[C@H](O)CO CNP0199934.2 [2,0,0,0,0,0|2,0,0]=4 56 B6R0.7 CC(=O)C(C)(C)O CNP0323322.0 [2,0,0,0,0,0|1,0,1]=4 57 B6R0.7 CC(C)C(C)(C)C CNP0107952.0 [2,0,0,0,0,0|1,0,0]=3 58 B6R0.7 CC(O)C(C)(C)O CNP0491018.0 [2,0,0,0,0,0|1,0,0]=3 59 B6R0.8 C=CC(C)(O)CC CNP0352178.0 [2,0,0,0,0,0|0,0,2]=4 60 B6R0.8 CCC(C)(C)CC CNP0117655.0 [2,0,0,0,0,0|1,0,0]=3 61 B6R0.8 CCC(C)(C)SC CNP0141733.0 [2,0,0,0,0,0|2,0,0]=4 62 B6R0.8 CCC(C)(O)CC CNP0314635.0 [2,0,0,0,0,0|0,0,0]=2 63 B6R0.8 CCC(C)(O)CO CNP0308368.0 [2,0,0,0,0,0|1,0,0]=3 64 B6R0.8 CC[C@@](C)(O)C#N CNP0366563.1 [2,0,0,0,0,0|1,0,1]=4 65 B6R0.2 CC(=CC(C)C)C CNP0084966.0 [2,0,0,0,0,0|0,0,2]=4 66 B6R0.2 CC(=O)CC(C)C CNP0178924.0 [2,0,0,0,0,0|1,0,1]=4 67 B6R0.2 CC(C)CC(C)C CNP0241759.0 [2,0,0,0,0,0|0,0,0]=2 68 B6R0.2 CC(C)CC(C)O CNP0493734.0 [2,0,0,0,0,0|1,0,0]=3 69 B6R0.2 CC(C)C[C@@H](C)N CNP0556567.1 [2,0,0,0,0,0|1,0,0]=3 70 B6R0.2 CC(C)C[S@@+](C)[O-] CNP0553779.1 [2,0,0,0,0,0|2,0,0]=4 71 B6R0.2 CC(C)C[S@@H+](C)[O-] CNP0593384.1 [2,0,0,0,0,0|2,0,0]=4 72 B6R0.2 CC(C)NC(C)C CNP0209283.0 [2,0,0,0,0,0|1,0,0]=3 73 B6R0.2 CC(C)SC(C)C CNP0213199.0 [2,0,0,0,0,0|1,0,0]=3 74 B6R0.2 C[C@@H](O)C[C@@H](C)O CNP0138640.1 [2,0,0,0,0,0|2,0,0]=4 75 B8R0.12 C=CCC(C)(O)C(C)C CNP0517978.0 [1,1,0,0,0,0|0,0,1]=3 76 B8R0.12 CC#C[C@@](C)(O)C(C)C CNP0063255.2 [1,1,0,0,0,0|0,0,1]=3 77 B8R0.12 CC#C[C@](C)(O)C(C)C CNP0063255.1 [1,1,0,0,0,0|0,0,1]=3 78 B8R0.13 CC(O)(CO)[C@@H](O)CO CNP0176272.1 [1,1,0,0,0,0|2,0,0]=4 79 B8R0.13 CC=C(C)C(C)(C)CC CNP0314170.0 [1,1,0,0,0,0|1,0,1]=4 80 B8R0.13 CC[C@@](C)(O)C(=O)OC CNP0227433.1 [1,1,0,0,0,0|1,0,1]=4 81 B8R0.13 CO[C@H](C)C(C)(C)OC CNP0406293.1 [1,1,0,0,0,0|2,0,0]=4 82 B8R0.13 C[C@@](O)(CO)[C@@H](O)CO CNP0176272.3 [1,1,0,0,0,0|2,0,0]=4 83 B8R0.13 C[C@@](O)(CO)[C@H](O)CO CNP0176272.4 [1,1,0,0,0,0|2,0,0]=4 84 B8R0.13 C[C@](O)(CO)C(O)CO CNP0176272.5 [1,1,0,0,0,0|2,0,0]=4 85 B8R0.13 C[C@](O)(CO)[C@H](O)CO CNP0176272.2 [1,1,0,0,0,0|2,0,0]=4 86 B8R0.17 CCC(C)(C)C(C)(C)C CNP0484700.0 [1,1,0,0,0,0|1,0,0]=3 87 B8R0.36 CCC(C)(CC)C(C)C CNP0115184.0 [1,1,0,0,0,0|1,0,0]=3 88 B8R0.2 CCC(C)C(=O)C(C)C CNP0480087.0 [1,1,0,0,0,0|0,0,2]=4 89 B8R0.2 CC[C@H](C)[C@H](C)C(C)C CNP0324956.1 [1,1,0,0,0,0|0,0,0]=2 90 B8R0.2 COC(=O)C(C)C(C)C CNP0354391.0 [1,1,0,0,0,0|1,0,1]=4 91 B8R0.2 COC(=O)C(O)C(C)C CNP0612001.0 [1,1,0,0,0,0|1,0,1]=4 92 B8R0.2 C[C@@H](O)[C@@H](O)[C@H](O)CO CNP0148651.3 [1,1,0,0,0,0|2,0,0]=4 93 B8R0.2 C[C@H](O)[C@@H](O)[C@@H](O)CO CNP0148651.4 [1,1,0,0,0,0|2,0,0]=4 94 B8R0.2 C[C@H](O)[C@@H](O)[C@H](O)CO CNP0148651.2 [1,1,0,0,0,0|2,0,0]=4 95 B8R0.2 C[C@H](O)[C@H](O)[C@H](O)CO CNP0148651.1 [1,1,0,0,0,0|2,0,0]=4 96 B8R0.18 CC(C)C(=NO)C(C)C CNP0192738.0 [1,1,0,0,0,0|0,0,1]=3 97 B8R0.18 CCC(C(C)C)C(C)C CNP0552066.0 [1,1,0,0,0,0|0,0,0]=2 98 B8R0.18 CCN(C(C)C)C(C)C CNP0029319.0 [1,1,0,0,0,0|1,0,0]=3 99 B10R0.164 CC(C)[C@@](O)(C(=O)O)[C@@H](C)O CNP0141390.3 [0,2,0,0,0,0|1,0,1]=4 100 B10R0.164 CC(C)[C@@](O)(C(=O)O)[C@H](C)O CNP0141390.2 [0,2,0,0,0,0|1,0,1]=4 101 B10R0.164 CC(C)[C@](O)(C(=O)O)[C@@H](C)O CNP0141390.1 [0,2,0,0,0,0|1,0,1]=4 102 B10R0.164 CC(C)[C@](O)(C(=O)O)[C@H](C)O CNP0141390.4 [0,2,0,0,0,0|1,0,1]=4 103 B8R1.19 CC1(CCC[C@@H]1O)C CNP0549501.1 [1,0,0,1,0,0|2,0,0]=4 104 B8R1.19 CC1(CCC[C@H]1O)C CNP0549501.2 [1,0,0,1,0,0|2,0,0]=4 105 B8R1.19 C[C@H]1CCCC1(C)C CNP0142130.1 [1,0,0,1,0,0|1,0,0]=3 106 B8R1.50 CC1=C(C(CC1)C)C CNP0610113.0 [1,0,0,1,0,0|0,0,2]=4 107 B8R1.50 CC1CCC(C1=O)C CNP0569003.0 [1,0,0,1,0,0|0,0,2]=4 108 B8R1.50 CC1[C@@H](CC[C@H]1C)C CNP0152607.1 [1,0,0,1,0,0|0,0,0]=2 109 B8R1.50 CN1CCC(C1O)O CNP0479127.0 [1,0,0,1,0,0|2,0,0]=4 110 B8R1.50 C[C@@H]1[C@@H](CC[C@@H]1C)C CNP0152607.3 [1,0,0,1,0,0|0,0,0]=2 111 B8R1.50 C[C@H]1CC[C@H]([C@@H]1O)O CNP0330167.1 [1,0,0,1,0,0|1,0,0]=3 112 B8R1.50 C[C@H]1[C@@H](CC[C@@H]1C)C CNP0152607.2 [1,0,0,1,0,0|0,0,0]=2 113 B10R1.120 C[C@@H]1CC[C@@H](C(O1)(C)C)O CNP0252855.3 [0,0,0,1,0,1|2,0,0]=4 114 B10R1.120 C[C@H]1CC[C@@H](C(O1)(C)C)O CNP0252855.2 [0,0,0,1,0,1|2,0,0]=4 115 B10R1.120 C[C@H]1CC[C@H](C(O1)(C)C)O CNP0252855.1 [0,0,0,1,0,1|2,0,0]=4 116 B10R1.339 C=C1C[C@H](C([C@H]1C)(C)C)C CNP0483236.1 [0,1,0,1,0,0|1,0,1]=4 117 B8R0.34 C[C@H](O)C[C@](C)(O)CO CNP0530490.1 [1,0,0,0,0,1|2,0,0]=4 118 B8R0.23 CC(=O)C(O)CC(C)C CNP0003259.0 [1,0,0,0,0,1|1,0,1]=4 119 B8R0.23 CC(C)C[C@H](C)C(C)C CNP0297055.1 [1,0,0,0,0,1|0,0,0]=2 120 B8R0.23 CC(C)OC(=O)C(C)C CNP0251914.0 [1,0,0,0,0,1|0,0,2]=4 121 B10R0.165 CC(C)OP(=O)(C)OC(C)C CNP0077258.0 [0,0,0,0,0,2|1,0,1]=4