0 B8R0.3 CCCC(=O)C(=O)OC HY-W127546 [0,0,0,0,0,0|3,0,1]=4 1 B8R0.3 CCOC(=O)C(O)CC HY-W127500 [0,0,0,0,0,0|1,0,0]=1 2 B8R0.3 CCOC(=O)[C@H](N)CO HY-W042010 [0,0,0,0,0,0|2,0,0]=2 3 B7R0.5 CCOC(=O)C(C)=O HY-Y1362 [1,0,0,0,0,0|1,0,1]=3 4 B7R0.5 CCOC(=O)C(N)=S HY-78216 [1,0,0,0,0,0|2,0,1]=4 5 B7R0.5 CCOC(=O)[C@@H](C)N HY-W017350 [1,0,0,0,0,0|1,0,0]=2 6 B7R0.5 CCOC(=O)[C@H](C)N HY-I0517 [1,0,0,0,0,0|1,0,0]=2 7 B7R0.7 CCOC(=O)CCN HY-Y1153 [1,0,0,0,0,0|1,0,0]=2 8 B7R0.10 C=C(CBr)C(=O)OC HY-W016582 [1,0,0,0,0,0|1,0,2]=4 9 B7R0.10 CCC(=O)C(=O)O[Na] HY-W005355 [1,0,0,0,0,0|2,0,1]=4 10 B7R0.10 CCC(O)C(=O)O[Na] HY-W012790 [1,0,0,0,0,0|2,0,0]=3 11 B7R0.10 COC(=O)C(N)CO HY-W013622 [1,0,0,0,0,0|2,0,0]=3 12 B7R0.10 COC(=O)[C@@H](N)CO HY-32687A [1,0,0,0,0,0|2,0,0]=3 13 B7R0.10 COC(=O)[C@@H](N)CS HY-B1038 [1,0,0,0,0,0|2,0,0]=3 14 B7R0.10 COC(=O)[C@H](N)CS HY-W018865 [1,0,0,0,0,0|2,0,0]=3 15 B7R0.10 O=C(CO)[C@@H](O)CO HY-W441330 [1,0,0,0,0,0|3,0,0]=4 16 B7R0.10 [C@@H](N)(CO)C(=O)OC HY-W015533 [1,0,0,0,0,0|2,0,0]=3 17 B7R0.10 [C@H](C)(CC)[C@H](N)CO HY-W015875 [1,0,0,0,0,0|2,0,1]=4 18 B9R0.6 CCOC(=O)C(Cl)C(C)=O HY-Y0364 [0,1,0,0,0,0|1,0,1]=3 19 B9R0.6 CCOC(=O)C(N)C(C)C HY-W099254 [0,1,0,0,0,0|1,0,0]=2 20 B9R0.6 CCOC(=O)[C@@H](N)[C@@H](C)O HY-W040333 [0,1,0,0,0,0|1,0,0]=2 21 B9R0.23 CC(C)OC(=O)[C@@H](N)CO HY-Z0711 [0,1,0,0,0,0|2,0,0]=3 22 B9R0.27 CCC(C)C(=O)C(=O)O[Na] HY-W017386 [0,1,0,0,0,0|3,0,0]=4 23 B9R0.35 CCCC(C)C(=O)OCC HY-W015667 [0,1,0,0,0,0|0,0,0]=1 24 B9R0.35 CCC[C@H](N)C(=O)OCC HY-75949 [0,1,0,0,0,0|1,0,0]=2 25 B9R1.5 N[C@H]1CCCCNC1=O HY-W015366 [0,0,0,1,0,0|2,0,0]=3 26 B9R1.73 CCOC(=O)C1CNC1 HY-W052600 [0,0,0,1,0,0|1,0,0]=2 27 B9R0.34 CCOC(=O)CC(=O)CC HY-78211 [0,0,0,0,0,1|1,0,1]=3 28 B6R0.1 C=CCC(=O)OC HY-W105369 [2,0,0,0,0,0|0,0,2]=4 29 B6R0.1 CCCC(=O)O[Na] HY-B0350A [2,0,0,0,0,0|1,0,0]=3 30 B6R0.1 CCOC(=O)CN HY-76204 [2,0,0,0,0,0|1,0,0]=3 31 B6R0.1 COC(=O)CCN HY-W007648 [2,0,0,0,0,0|1,0,0]=3 32 B6R0.1 COC(=O)CCO HY-42569 [2,0,0,0,0,0|1,0,0]=3 33 B6R0.1 COC(=O)OCCl HY-43384 [2,0,0,0,0,0|2,0,0]=4 34 B6R0.1 O=C(CCO)O[Na] HY-W095705A [2,0,0,0,0,0|2,0,0]=4 35 B6R0.6 C(CO)=CCCC HY-W015936 [2,0,0,0,0,0|2,0,0]=4 36 B6R0.6 CC\C=C/CCO HY-W010607 [2,0,0,0,0,0|2,0,0]=4 37 B6R0.3 C=C(C)C(=O)OC HY-W391506 [2,0,0,0,0,0|0,0,2]=4 38 B6R0.3 CC(C)[13C](=O)O[Na] HY-W021400S [2,0,0,0,0,0|1,0,0]=3 39 B6R0.3 CC(CBr)C(=O)O HY-W015332 [2,0,0,0,0,0|1,0,0]=3 40 B6R0.3 CC(CN)C(=O)O HY-W012974 [2,0,0,0,0,0|1,0,0]=3 41 B6R0.3 CC(CN)C(=O)O HY-W012974R [2,0,0,0,0,0|1,0,0]=3 42 B6R0.3 CC(CO)C(=O)O HY-113126 [2,0,0,0,0,0|1,0,0]=3 43 B6R0.3 CC(O)C(=O)O[Na] HY-B2227B [2,0,0,0,0,0|2,0,0]=4 44 B6R0.3 CCC(=O)C(=O)O HY-W007926 [2,0,0,0,0,0|1,0,1]=4 45 B6R0.3 CCC(=O)C(=O)O HY-W007926R [2,0,0,0,0,0|1,0,1]=4 46 B6R0.3 CCC(=O)C(C)=O HY-W012998 [2,0,0,0,0,0|1,0,1]=4 47 B6R0.3 CCC(N)C(=O)O HY-W010590 [2,0,0,0,0,0|1,0,0]=3 48 B6R0.3 CCC(O)C(=O)O HY-113381 [2,0,0,0,0,0|1,0,0]=3 49 B6R0.3 CC[C@@H](N)C(=O)O HY-Y0127 [2,0,0,0,0,0|1,0,0]=3 50 B6R0.3 CC[C@H](N)C(N)=O HY-79491 [2,0,0,0,0,0|2,0,0]=4 51 B6R0.3 CC[C@H](O)C(=O)O HY-W018499 [2,0,0,0,0,0|1,0,0]=3 52 B6R0.3 COC(=O)C(C)N HY-W010324 [2,0,0,0,0,0|1,0,0]=3 53 B6R0.3 COC(=O)[C@H](C)N HY-I0519 [2,0,0,0,0,0|1,0,0]=3 54 B6R0.3 CON(C)C(C)=O HY-W001095 [2,0,0,0,0,0|2,0,0]=4 55 B6R0.3 C[C@@H](CN)C(=O)O HY-113380 [2,0,0,0,0,0|1,0,0]=3 56 B6R0.3 C[C@@H](CN)C(=O)O HY-W023323 [2,0,0,0,0,0|1,0,0]=3 57 B6R0.3 C[C@@H](O)C(=O)O[Na] HY-111095B [2,0,0,0,0,0|2,0,0]=4 58 B6R0.3 C[C@H](O)C(=O)O[Na] HY-W040233 [2,0,0,0,0,0|2,0,0]=4 59 B6R0.3 C[C@H](O)C(=O)O[Na] HY-W040233B [2,0,0,0,0,0|2,0,0]=4 60 B6R0.3 C[C@H](O)C(=O)O[Na] HY-W040233R [2,0,0,0,0,0|2,0,0]=4 61 B6R0.3 C\C=C(/C)C(=O)O HY-W012999 [2,0,0,0,0,0|0,0,2]=4 62 B6R0.3 NC(CO)C(=O)O HY-Y0507 [2,0,0,0,0,0|2,0,0]=4 63 B6R0.3 NC(CS)C(=O)O HY-W013651 [2,0,0,0,0,0|2,0,0]=4 64 B6R0.3 NC(CS)C(=O)O HY-W016716 [2,0,0,0,0,0|2,0,0]=4 65 B6R0.3 NCC(N)C(=O)O HY-W013674 [2,0,0,0,0,0|2,0,0]=4 66 B6R0.3 NC[C@@H](N)C(=O)O HY-W010312 [2,0,0,0,0,0|2,0,0]=4 67 B6R0.3 NC[C@H](N)C(=O)O HY-W013673 [2,0,0,0,0,0|2,0,0]=4 68 B6R0.3 N[13C@@H]([13CH2]O)[13C](=O)O HY-N0650S [2,0,0,0,0,0|2,0,0]=4 69 B6R0.3 N[C@@H](CCl)C(=O)O HY-107373 [2,0,0,0,0,0|2,0,0]=4 70 B6R0.3 N[C@@H](CO)C(=O)O HY-N0650 [2,0,0,0,0,0|2,0,0]=4 71 B6R0.3 N[C@@H](CO)C(=O)O HY-N0650R [2,0,0,0,0,0|2,0,0]=4 72 B6R0.3 N[C@@H](CO)[13C](=O)O HY-N0650S2 [2,0,0,0,0,0|2,0,0]=4 73 B6R0.3 N[C@@H](CS)C(=O)O HY-W016715 [2,0,0,0,0,0|2,0,0]=4 74 B6R0.3 N[C@@H](CS)C(=O)O HY-W016715R [2,0,0,0,0,0|2,0,0]=4 75 B6R0.3 N[C@@H](CS)C(=O)O HY-Y0337 [2,0,0,0,0,0|2,0,0]=4 76 B6R0.3 N[C@@H](CS)C(=O)O HY-Y0337A [2,0,0,0,0,0|2,0,0]=4 77 B6R0.3 N[C@@H](CS)C(=O)O HY-Y0337R [2,0,0,0,0,0|2,0,0]=4 78 B6R0.3 N[C@H](CCl)C(=O)O HY-W015457 [2,0,0,0,0,0|2,0,0]=4 79 B6R0.3 N[C@H](CO)C(=O)O HY-100808 [2,0,0,0,0,0|2,0,0]=4 80 B6R0.3 N[C@H](CS)C(=O)O HY-W002074 [2,0,0,0,0,0|2,0,0]=4 81 B6R0.3 N[C@H](CS)C(=O)O HY-W018555 [2,0,0,0,0,0|2,0,0]=4 82 B6R0.3 N[C@H](CS)C(=O)O HY-W055811 [2,0,0,0,0,0|2,0,0]=4 83 B6R0.3 O=C(O)C(O)CO HY-W018035 [2,0,0,0,0,0|2,0,0]=4 84 B6R0.3 [13CH3][C@H](O)C(=O)O[Na] HY-B2227BS3 [2,0,0,0,0,0|2,0,0]=4 85 B6R0.3 [C@@H](C)(NC)C(=O)O HY-W015926 [2,0,0,0,0,0|1,0,0]=3 86 B6R0.3 [C@H](C)(N)C(=O)OC HY-W007986 [2,0,0,0,0,0|1,0,0]=3 87 B6R0.3 [C@H](N)(CC)C(=O)O HY-W010589 [2,0,0,0,0,0|1,0,0]=3 88 B6R0.3 [C@H](O)(CN)C(=O)O HY-W012967 [2,0,0,0,0,0|2,0,0]=4 89 B6R0.3 [Li]OC(=O)C(C)O HY-W010625 [2,0,0,0,0,0|2,0,0]=4 90 B6R0.3 [Li]OC(=O)[C@H](C)O HY-D0884 [2,0,0,0,0,0|2,0,0]=4 91 B8R0.14 CC(C)(C)C(=O)OCCl HY-Y0643 [1,1,0,0,0,0|1,0,0]=3 92 B8R0.5 CCOC(=O)C=C(C)C HY-41314 [1,1,0,0,0,0|0,0,2]=4 93 B8R0.5 CCOC(=O)CC(=O)O HY-Y1031 [1,1,0,0,0,0|1,0,1]=4 94 B8R0.5 CCOC(=O)CC(C)=O HY-Y1093 [1,1,0,0,0,0|0,0,1]=3 95 B8R0.5 CCOC(=O)CC(C)O HY-W012701 [1,1,0,0,0,0|0,0,0]=2 96 B8R0.5 CCOC(=O)CN(C)C HY-W012705 [1,1,0,0,0,0|1,0,0]=3 97 B8R0.5 CCOC(=O)C[C@H](C)O HY-W076441 [1,1,0,0,0,0|0,0,0]=2 98 B8R0.5 CCOC(=O)C[N+](=O)[O-] HY-76486 [1,1,0,0,0,0|2,0,0]=4 99 B10R0.2 CCCC(=O)CC(=O)OCC HY-W015487 [0,1,0,0,0,1|1,0,1]=4 100 B10R0.2 CCOC(=O)OC(=O)OCC HY-D0846 [0,1,0,0,0,1|1,0,1]=4 101 B10R0.19 CCOC(=O)[C@@H](N)CCSC HY-W052212 [0,2,0,0,0,0|1,0,0]=3 102 B10R0.40 CCC(C)(C)C(=O)OCCO HY-112531 [0,2,0,0,0,0|0,0,0]=2 103 B10R0.40 CCC(C)(C)C(=O)OCCO HY-112531A [0,2,0,0,0,0|0,0,0]=2 104 B10R0.40 CCC(C)(C)C(=O)OCCO HY-112531B [0,2,0,0,0,0|0,0,0]=2 105 B10R0.57 CCC(C)C(=O)NCC(=O)O HY-W141919 [0,2,0,0,0,0|1,0,1]=4 106 B10R0.32 CCOC(=O)C(O)CC(C)C HY-W114581 [0,2,0,0,0,0|1,0,0]=3 107 B10R0.32 [C@H](N)(CC(C)C)C(=O)OCC HY-W009892 [0,2,0,0,0,0|1,0,0]=3 108 B8R1.18 CC1CC(=O)OC1=O HY-Z0059 [1,0,0,1,0,0|1,0,1]=4 109 B8R1.4 CC1CCN=C(N)C1 HY-138564 [1,0,0,1,0,0|2,0,0]=4 110 B8R1.11 CCN1CCCC1=O HY-B1620 [1,0,0,1,0,0|1,0,0]=3 111 B8R1.11 CCN1CCCC1=O HY-B1620B [1,0,0,1,0,0|1,0,0]=3 112 B8R1.11 CCN1CCCC1=O HY-B1620H [1,0,0,1,0,0|1,0,0]=3 113 B8R1.11 CCN1CCCC1=O HY-B1620I [1,0,0,1,0,0|1,0,0]=3 114 B8R1.11 CCN1CCCC1=O HY-B1620J [1,0,0,1,0,0|1,0,0]=3 115 B8R1.11 CCN1CCCC1=O HY-B1620L [1,0,0,1,0,0|1,0,0]=3 116 B8R1.11 CCN1CCCC1=O HY-B1620O [1,0,0,1,0,0|1,0,0]=3 117 B8R1.39 COC(=O)C1(N)CC1 HY-W008219 [1,0,0,1,0,0|1,0,0]=3 118 B10R1.149 CCC(C)N1CCCC1=O HY-B2234 [0,0,0,1,0,1|1,0,0]=3