0 B8R0.8 C=C(C)C(=O)OCCO HY-W012723 [0,0,0,0,0,0|2,0,1]=3 1 B7R0.3 COC(=O)CCCBr HY-W004701 [1,0,0,0,0,0|3,0,0]=4 2 B7R0.3 COC(=O)CCCN HY-79594 [1,0,0,0,0,0|3,0,0]=4 3 B7R0.4 CCCCCC(C)O HY-W015879 [1,0,0,0,0,0|2,0,1]=4 4 B7R0.5 CCCC(=O)C(=O)O HY-113098 [1,0,0,0,0,0|2,0,1]=4 5 B7R0.5 CCOC(=O)C(C)=O HY-Y1362 [1,0,0,0,0,0|1,0,2]=4 6 B7R0.5 CCOC(=O)[C@@H](C)N HY-W017350 [1,0,0,0,0,0|2,0,0]=3 7 B7R0.5 CCOC(=O)[C@H](C)N HY-I0517 [1,0,0,0,0,0|2,0,0]=3 8 B9R0.3 O=C(NCCO)C(F)(F)F HY-20755 [0,1,0,0,0,0|2,0,0]=3 9 B9R0.7 C=C(C)C(=O)NCC(C)O HY-W077028 [0,1,0,0,0,0|1,0,1]=3 10 B9R0.7 CC(C)C(=O)NCC(=O)O HY-W141928 [0,1,0,0,0,0|1,0,1]=3 11 B9R0.7 CC(S)C(=O)NCC(=O)O HY-B0373 [0,1,0,0,0,0|0,1,1]=3 12 B9R0.7 O=C(O)CNC(=O)C(=O)O HY-12315 [0,1,0,0,0,0|1,0,2]=4 13 B9R1.5 N[C@H]1CCCCNC1=O HY-W015366 [0,0,0,1,0,0|2,0,0]=3 14 B9R1.69 C[C@@H]1NC(=O)CNC1=O HY-75564 [0,0,0,1,0,0|1,0,2]=4 15 B6R0.1 CCOC(=O)CN HY-76204 [2,0,0,0,0,0|2,0,0]=4 16 B6R0.1 COC(=O)CCN HY-W007648 [2,0,0,0,0,0|2,0,0]=4 17 B6R0.1 COC(=O)CCO HY-42569 [2,0,0,0,0,0|1,0,0]=3 18 B6R0.1 O=C(CCO)O[Na] HY-W095705A [2,0,0,0,0,0|2,0,0]=4 19 B6R0.4 CC(C)CCCO HY-W007511 [2,0,0,0,0,0|1,0,1]=4 20 B6R0.4 NCCCC(=O)O HY-N0067 [2,0,0,0,0,0|2,0,0]=4 21 B6R0.4 NCCCC(=O)O HY-N0067R [2,0,0,0,0,0|2,0,0]=4 22 B6R0.6 C(CO)=CCCC HY-W015936 [2,0,0,0,0,0|2,0,0]=4 23 B6R0.6 CCCCCCO HY-W032022 [2,0,0,0,0,0|1,0,1]=4 24 B6R0.6 CC\C=C/CCO HY-W010607 [2,0,0,0,0,0|1,0,0]=3 25 B6R0.6 OCCOCCO HY-B1952 [2,0,0,0,0,0|1,0,1]=4 26 B6R0.3 CC(O)C(=O)O[Na] HY-B2227B [2,0,0,0,0,0|2,0,0]=4 27 B6R0.3 CCC(=O)C(=O)O HY-W007926 [2,0,0,0,0,0|1,0,1]=4 28 B6R0.3 CCC(=O)C(=O)O HY-W007926R [2,0,0,0,0,0|1,0,1]=4 29 B6R0.3 CCC(=O)C(C)=O HY-W012998 [2,0,0,0,0,0|0,0,2]=4 30 B6R0.3 COC(=O)C(C)N HY-W010324 [2,0,0,0,0,0|2,0,0]=4 31 B6R0.3 COC(=O)[C@H](C)N HY-I0519 [2,0,0,0,0,0|2,0,0]=4 32 B6R0.3 C[C@@H](O)C(=O)O[Na] HY-111095B [2,0,0,0,0,0|2,0,0]=4 33 B6R0.3 C[C@H](O)C(=O)O[Na] HY-W040233 [2,0,0,0,0,0|2,0,0]=4 34 B6R0.3 C[C@H](O)C(=O)O[Na] HY-W040233B [2,0,0,0,0,0|2,0,0]=4 35 B6R0.3 C[C@H](O)C(=O)O[Na] HY-W040233R [2,0,0,0,0,0|2,0,0]=4 36 B6R0.3 [13CH3][C@H](O)C(=O)O[Na] HY-B2227BS3 [2,0,0,0,0,0|2,0,0]=4 37 B6R0.3 [C@H](C)(N)C(=O)OC HY-W007986 [2,0,0,0,0,0|2,0,0]=4 38 B6R0.3 [Li]OC(=O)C(C)O HY-W010625 [2,0,0,0,0,0|2,0,0]=4 39 B6R0.3 [Li]OC(=O)[C@H](C)O HY-D0884 [2,0,0,0,0,0|2,0,0]=4 40 B8R0.1 CCOC(=O)CCCN HY-W010078 [1,1,0,0,0,0|2,0,0]=4 41 B8R0.9 CCC(=O)NCC(=O)O HY-W587803 [1,1,0,0,0,0|0,0,1]=3 42 B8R0.9 NCC(=O)NCC(=O)O HY-D0889R [1,1,0,0,0,0|1,0,1]=4 43 B10R0.28 CC(C)(C)OC(=O)CCCO HY-W019095 [0,1,0,0,0,1|2,0,0]=4 44 B10R0.28 CC(C)(C)OC(=O)NCCN HY-40171 [0,1,0,0,0,1|2,0,0]=4 45 B10R0.28 CC(C)(C)OC(=O)NCCO HY-W007322 [0,1,0,0,0,1|1,0,0]=3 46 B10R0.28 CC(C)(C)OC(=O)NCCS HY-134853 [0,1,0,0,0,1|1,1,0]=4 47 B10R0.96 CC(C)CC(=O)NCC(=O)O HY-W015464 [0,1,0,0,0,1|1,0,1]=4 48 B10R0.40 CCC(C)(C)C(=O)OCCO HY-112531 [0,2,0,0,0,0|2,0,0]=4 49 B10R0.40 CCC(C)(C)C(=O)OCCO HY-112531A [0,2,0,0,0,0|2,0,0]=4 50 B10R0.40 CCC(C)(C)C(=O)OCCO HY-112531B [0,2,0,0,0,0|2,0,0]=4 51 B10R0.57 CCC(C)C(=O)NCC(=O)O HY-W141919 [0,2,0,0,0,0|1,0,1]=4 52 B10R0.57 N[C@@H](CS)C(=O)NCC(=O)O HY-113110 [0,2,0,0,0,0|1,0,1]=4 53 B10R0.57 N[C@@H](CS)C(=O)NCC(=O)O HY-113110A [0,2,0,0,0,0|1,0,1]=4 54 B10R0.93 CC(N)C(=O)NC(C)C(=O)O HY-W015449 [0,2,0,0,0,0|1,0,1]=4 55 B10R0.93 C[C@@H](N)C(=O)N[C@H](C)C(=O)O HY-W015450 [0,2,0,0,0,0|1,0,1]=4 56 B10R0.93 C[C@@H](N)C(=O)N[C@H](C)C(=O)O HY-W015450R [0,2,0,0,0,0|1,0,1]=4 57 B10R0.93 C[C@H](N)C(=O)N[C@@H](C)C(=O)O HY-W010162 [0,2,0,0,0,0|1,0,1]=4 58 B10R0.93 C[C@H](N)C(=O)N[C@H](C)C(=O)O HY-W250715 [0,2,0,0,0,0|1,0,1]=4 59 B8R1.1 CCC1CCC(=O)O1 HY-W015892 [1,0,0,1,0,0|2,0,0]=4 60 B8R1.5 CC1CCCCC1=O HY-W010549 [1,0,0,1,0,0|2,0,0]=4 61 B8R1.5 NC1CCCNC1=O HY-21088 [1,0,0,1,0,0|2,0,0]=4 62 B8R1.5 N[C@H]1CCCNC1=O HY-W003592A [1,0,0,1,0,0|2,0,0]=4 63 B8R1.22 O=C1CCCCCN1 HY-W010542 [1,0,0,1,0,0|1,0,0]=3 64 B8R1.22 O=C1CCCCCO1 HY-W015891 [1,0,0,1,0,0|2,0,0]=4 65 B8R1.22 O=C1CCCCCO1 HY-W392100B [1,0,0,1,0,0|2,0,0]=4 66 B8R1.22 O=C1CCCNCC1 HY-W001845 [1,0,0,1,0,0|2,0,0]=4 67 B8R1.50 O=C1OCC(O)[C@@H]1O HY-W357137 [1,0,0,1,0,0|1,0,0]=3 68 B8R1.18 CC1=CC(=O)C(C)O1 HY-W010553 [1,0,0,1,0,0|1,0,1]=4