0 B8R0.9 CCC(=O)NCC(C)C 4148-1-0W [0,0,0,0,0,0|3,0,1]=4 1 B7R0.4 CNCCOC(C)=O 4133-5-03 [1,0,0,0,0,0|2,0,1]=4 2 B7R0.4 C\C=C\C=C\C(C)=O 2317-1-0E [1,0,0,0,0,0|1,0,2]=4 3 B9R0.24 COC(=O)CCS(=O)OC 6165-1-07 [0,1,0,0,0,0|1,0,0]=2 4 B9R0.48 CCOC(=O)\C=C\C(C)=O 2329-1-07 [0,1,0,0,0,0|0,0,2]=3 5 B9R1.35 O=C1CCC(C(=O)Cl)N1 4H48-5-DJ [0,0,0,1,0,0|3,0,0]=4 6 B9R1.35 O=C1CC[C@@H](C(=O)O)C1 2229-1-R2 [0,0,0,1,0,0|2,0,0]=3 7 B9R1.35 O=C1CC[C@H](C(=O)O)C1 2229-1-S2 [0,0,0,1,0,0|2,0,0]=3 8 B9R1.82 COC(=O)C1CC(Br)C1 2223-9-05 [0,0,0,1,0,0|1,0,1]=3 9 B9R1.82 COC(=O)[C@H]1C[C@H](Br)C1 2223-9-00 [0,0,0,1,0,0|1,0,1]=3 10 B9R1.95 COC1CC(C(=O)O)C1 2221-1-37 [0,0,0,1,0,0|2,0,1]=4 11 B9R1.95 CO[C@H]1C[C@H](C(=O)O)C1 2221-1-E0 [0,0,0,1,0,0|2,0,1]=4 12 B7R0.2 COC(=O)CC(=N)N 4158-5-51 [0,0,0,0,1,0|2,0,0]=3 13 B7R0.2 O=C(O)CC(=O)CCl 2129-5-0F [0,0,0,0,1,0|3,0,0]=4 14 B9R0.1 O=C(O)CCNC(=O)CBr 4158-9-04 [0,0,0,0,0,1|3,0,0]=4 15 B8R0.1 CCOC(=O)CCC#N 4137-1-0R [1,1,0,0,0,0|1,0,1]=4 16 B8R0.3 C=CC[C@H](N)C(=O)OC 4358-1-S0 [1,1,0,0,0,0|0,0,1]=3 17 B8R0.3 CCCC(Br)C(=O)OC 2123-9-0L [1,1,0,0,0,0|0,0,1]=3 18 B8R0.3 CCC[C@@H](N)C(=O)OC 4158-1-R00 [1,1,0,0,0,0|0,0,1]=3 19 B8R0.3 COC(=O)[C@H](C)N=C=O 4158-1-S07 [1,1,0,0,0,0|1,0,1]=4 20 B8R0.6 CCCSCC(=O)OC 6166-1-0C [1,1,0,0,0,0|0,0,1]=3 21 B8R0.6 CNCCCC(=O)OC 4133-5-00 [1,1,0,0,0,0|0,0,1]=3 22 B8R0.6 COC(=O)OCCCF 2128-3-97 [1,1,0,0,0,0|1,0,1]=4 23 B8R0.19 COC(=O)C[C@@H](O)CCl 2129-5-R0 [1,1,0,0,0,0|1,0,1]=4 24 B8R0.23 C=C(C)C[C@H](N)C(=O)O 4357-1-S3 [1,1,0,0,0,0|1,0,0]=3 25 B8R0.29 CC(C)(S)CCC(=O)O 6161-1-10 [1,1,0,0,0,0|0,1,1]=4 26 B8R0.29 CS(C)(=O)=NCC(=O)O 8169-1-0A [1,1,0,0,0,0|2,0,0]=4 27 B10R0.3 C=C(C)CCCC(=O)OCC 2323-1-X7 [0,1,0,0,0,1|1,0,0]=3 28 B10R0.57 COC(=O)[C@@H](N)CCC(N)=O 4158-5-SX [0,1,0,0,0,1|1,0,0]=3 29 B10R0.52 COC(=O)CC(N)C(C)(C)C 4158-1-85 [0,2,0,0,0,0|1,0,1]=4 30 B10R0.52 COC(=O)CC(O)C(C)(C)C 2129-1-71 [0,2,0,0,0,0|1,0,1]=4 31 B10R0.109 CCOC(=O)CCS(=O)(=O)Cl 6162-5-11 [0,2,0,0,0,0|2,0,0]=4 32 B8R1.1 C=CC1COC(=O)C1 2H25-1-2G [1,0,0,1,0,0|0,0,1]=3 33 B8R1.5 CC1COCCC1=O 2H17-1-79 [1,0,0,1,0,0|2,0,0]=4 34 B8R1.7 O=C(O)[C@H]1CCOC1 2H21-1-S0 [1,0,0,1,0,0|1,0,1]=4 35 B8R1.23 CC(=O)C1CC(O)C1 2229-1-0T [1,0,0,1,0,0|0,0,2]=4 36 B8R1.23 C[C@H]1C[C@H](C(=O)O)C1 2221-1-30 [1,0,0,1,0,0|1,0,1]=4 37 B8R1.23 N[C@H]1C[C@@H](C(=O)O)C1 4257-1-27 [1,0,0,1,0,0|1,0,1]=4 38 B8R1.23 O=C(O)C1CC(Cl)C1 2221-5-05 [1,0,0,1,0,0|1,0,1]=4 39 B8R1.23 O=C(O)[C@H]1C[C@@H](F)C1 2221-3-Z2 [1,0,0,1,0,0|1,0,1]=4 40 B8R1.23 O=C(O)[C@H]1C[C@H](Cl)C1 2221-5-E0 [1,0,0,1,0,0|1,0,1]=4 41 B8R1.23 O=C(O)[C@H]1C[C@H](F)C1 2221-3-E2 [1,0,0,1,0,0|1,0,1]=4 42 B8R1.23 O=C(O)[C@H]1C[C@H](O)C1 2229-1-E2 [1,0,0,1,0,0|0,0,2]=4 43 B8R1.51 O=C1CCS(=O)(=O)C1 6H63-1-09 [1,0,0,1,0,0|1,0,1]=4 44 B10R1.13 O=C1CCC(C(=O)Cl)CC1 2216-5-02 [0,0,0,1,0,1|2,0,0]=4 45 B10R1.14 COC(=O)[C@@H]1CCC(=O)C1 2229-1-R0 [0,0,0,1,0,1|0,0,0]=2 46 B10R1.14 COC(=O)[C@@H]1CC[C@H](N)C1 4258-5-11 [0,0,0,1,0,1|1,0,1]=4 47 B10R1.14 COC(=O)[C@H]1CCC(=O)C1 2229-1-S0 [0,0,0,1,0,1|0,0,0]=2 48 B10R1.14 COC(=O)[C@H]1CC[C@@H](N)C1 4233-5-05 [0,0,0,1,0,1|1,0,1]=4 49 B10R1.54 O=C(O)C[C@@H]1CCC(=O)N1 4H48-1-SN [0,0,0,1,0,1|2,0,0]=4 50 B10R1.150 COC(=O)CC1CC(=O)C1 2229-1-0P [0,0,0,1,0,1|0,0,0]=2 51 B10R1.150 COC(=O)CC1CC(O)C1 2229-1-0S [0,0,0,1,0,1|0,0,2]=4 52 B10R1.408 COC(=O)C1CC1C(=O)O 2223-1-1A [0,0,0,1,0,1|1,0,0]=3 53 B10R1.83 CC1(C)C(=O)CC1C(=O)O 2229-1-56 [0,1,0,1,0,0|2,0,0]=4 54 B10R1.184 COC(=O)[C@H](O)CC1CC1 2229-1-R3 [0,1,0,1,0,0|1,0,1]=4 55 B10R1.424 COC(=O)C1(F)CC(O)C1 2229-3-04 [0,1,0,1,0,0|0,0,2]=4 56 B10R1.424 COC(=O)[C@]1(C)C[C@@H](O)C1 2229-1-E0 [0,1,0,1,0,0|0,0,2]=4 57 B10R1.424 COC(=O)[C@]1(C)C[C@H](O)C1 2229-1-Z0 [0,1,0,1,0,0|0,0,2]=4 58 B10R1.169 COC(=O)C1CC(CN)C1 4258-5-13 [0,1,0,1,0,0|1,0,1]=4 59 B10R1.113 O=C1CCCC(C(=O)O)C1 2229-1-X0 [0,1,0,1,0,0|2,0,0]=4 60 B10R1.140 CCOC(=O)C1CC(I)C1 2223-H-00 [0,1,0,1,0,0|1,0,1]=4 61 B10R2.376 COC(=O)C12CC(C1)C2 2223-1-68 [0,0,0,2,0,0|1,0,1]=4