0 B9R0.23 COC(=O)C(=O)CC(C)=O 2129-1-Y3 [0,0,0,0,0,0|1,0,3]=4 1 B9R0.23 COC(=O)[C@@H](N)CC(C)C 4158-5-SG [0,0,0,0,0,0|1,0,0]=1 2 B9R0.23 COC(=O)[C@H](N)CC(C)C 4158-5-RG [0,0,0,0,0,0|1,0,0]=1 3 B8R0.3 COCC(Br)C(=O)OC 2123-9-23 [1,0,0,0,0,0|2,0,0]=3 4 B8R0.9 COC(=O)OCC(F)F 2128-3-03 [1,0,0,0,0,0|3,0,0]=4 5 B8R0.9 COC(=O)\C=C\C(C)C 2323-1-X3 [1,0,0,0,0,0|0,0,2]=3 6 B8R0.23 CC(C)C[C@H](O)C(=O)O 2129-1-SB [1,0,0,0,0,0|0,0,0]=1 7 B8R0.23 O=C(O)C[C@@H](O)C(=O)O 2129-1-49 [1,0,0,0,0,0|2,0,1]=4 8 B10R0.32 CCOC(=O)[C@H](N)CC(C)C 4158-5-RA [0,1,0,0,0,0|1,0,0]=2 9 B10R0.46 COC(=O)C[C@H](O)C(=O)OC 2129-1-56 [0,1,0,0,0,0|1,0,1]=3 10 B10R1.14 COC(=O)C1CCC(=O)C1 2229-1-X4 [0,0,0,1,0,0|2,0,1]=4 11 B10R1.14 COC(=O)[C@@H]1CC[C@H](N)C1 4258-5-30 [0,0,0,1,0,0|2,0,0]=3 12 B10R1.14 COC(=O)[C@@H]1C[C@@H](O)CN1 4H29-5-X3 [0,0,0,1,0,0|2,0,0]=3 13 B10R1.14 COC(=O)[C@H]1C[C@@H](O)CN1 4H29-5-X1 [0,0,0,1,0,0|2,0,0]=3 14 B10R1.14 COC(=O)[C@H]1C[C@H](O)CN1 4H29-5-X2 [0,0,0,1,0,0|2,0,0]=3 15 B7R0.3 C=CCCC(=O)OC 2323-1-0J [2,0,0,0,0,0|0,0,2]=4 16 B7R0.3 CC\C=C\C(=O)OC 2323-1-17 [2,0,0,0,0,0|0,0,2]=4 17 B7R0.3 CC\C=C\C(=O)OC 2323-1-E2 [2,0,0,0,0,0|0,0,2]=4 18 B7R0.3 CNCCC(=O)NC 4148-1-31 [2,0,0,0,0,0|2,0,0]=4 19 B7R0.3 COC(=O)CCCBr 2123-9-0H [2,0,0,0,0,0|1,0,0]=3 20 B7R0.3 COC(=O)CCCN 4158-5-18 [2,0,0,0,0,0|1,0,0]=3 21 B7R0.5 CCC[C@H](N)C(=O)O 4157-1-SN [2,0,0,0,0,0|1,0,0]=3 22 B7R0.5 COCC(Cl)C(=O)O 2121-5-X1 [2,0,0,0,0,0|2,0,0]=4 23 B7R0.5 COC[C@H](N)C(=O)O 4157-5-S0 [2,0,0,0,0,0|2,0,0]=4 24 B7R0.5 N[C@@H](CCO)C(=O)O 4157-1-SQ [2,0,0,0,0,0|2,0,0]=4 25 B7R0.10 C=CC(O)C(=O)OC 2129-1-79 [2,0,0,0,0,0|0,0,2]=4 26 B7R0.10 CCC(Br)C(=O)OC 2123-9-13 [2,0,0,0,0,0|1,0,0]=3 27 B7R0.10 CC[C@@H](N)C(=O)OC 4158-5-R8 [2,0,0,0,0,0|1,0,0]=3 28 B7R0.10 COC(=O)C(Br)CBr 2123-9-32 [2,0,0,0,0,0|2,0,0]=4 29 B7R0.10 COC(=O)[C@@H](N)CN 4158-5-S0 [2,0,0,0,0,0|2,0,0]=4 30 B7R0.2 CN(C)CC(O)CO 4156-1-0H [2,0,0,0,0,0|1,0,1]=4 31 B7R0.6 CC(=O)CCC(C)=O 2118-1-25 [2,0,0,0,0,0|1,0,1]=4 32 B7R0.6 CC(=O)\C=C\C(C)C 2317-1-04 [2,0,0,0,0,0|0,0,2]=4 33 B7R0.6 CC(C)CCC(=O)Cl 2116-5-0A [2,0,0,0,0,0|1,0,0]=3 34 B7R0.6 CC(C)COC(=O)Cl 2123-5-1N [2,0,0,0,0,0|2,0,0]=4 35 B7R0.6 CC(C)OCC(=O)O 2121-1-43 [2,0,0,0,0,0|1,0,0]=3 36 B7R0.6 CC(C)\C=C\C(=O)O 2321-1-13 [2,0,0,0,0,0|0,0,2]=4 37 B7R0.6 CN(C)CCC(=O)O 4158-5-13 [2,0,0,0,0,0|1,0,0]=3 38 B9R0.8 CCCCC(N)C(=O)OC 4157-5-03 [1,1,0,0,0,0|1,0,0]=3 39 B9R0.8 COC(=O)C(Br)CCCBr 2123-9-X1 [1,1,0,0,0,0|1,0,0]=3 40 B9R0.8 COC(=O)C(N)CCSC 8166-5-03 [1,1,0,0,0,0|1,0,0]=3 41 B9R0.35 CCCC(Br)C(=O)OCC 2123-9-05 [1,1,0,0,0,0|1,0,0]=3 42 B9R0.35 CCCC(O)C(=O)OCC 2129-1-52 [1,1,0,0,0,0|0,0,0]=2 43 B9R0.35 CCOC(=O)C(Cl)OCC 2123-5-X4 [1,1,0,0,0,0|2,0,0]=4 44 B9R0.21 COC(=O)CCC(F)(F)F 2123-3-70 [1,1,0,0,0,0|2,0,0]=4 45 B9R0.42 COC(=O)CC(=O)C(C)C 2129-1-68 [1,1,0,0,0,0|0,0,1]=3 46 B9R0.48 CCOC(=O)CCC(C)=O 2129-1-17 [1,1,0,0,0,0|1,0,1]=4 47 B9R0.48 CCOC(=O)CNC(C)C 4158-5-09 [1,1,0,0,0,0|1,0,0]=3 48 B9R0.25 COC(=O)C(O)C(F)(F)F 2129-3-07 [0,1,0,0,1,0|2,0,0]=4 49 B9R0.25 COC(=O)[C@@H](N)C(C)(C)C 4158-5-SU [0,1,0,0,1,0|1,0,0]=3 50 B11R0.39 COC(=O)[C@H](CC(C)C)N=C=S 8168-1-24 [0,2,0,0,0,0|0,1,0]=3 51 B9R1.11 COC(=O)C1=CCCC1 2423-1-04 [1,0,0,1,0,0|1,0,1]=4 52 B9R1.11 COC(=O)C1CCCC1 2223-1-48 [1,0,0,1,0,0|1,0,0]=3 53 B9R1.11 COC(=O)C1CCCN1 4H23-5-03 [1,0,0,1,0,0|1,0,0]=3 54 B9R1.11 COC(=O)C1CCNC1 4H58-5-4A [1,0,0,1,0,0|2,0,0]=4 55 B9R1.11 COC(=O)C1NCCS1 8H23-5-05 [1,0,0,1,0,0|1,1,0]=4 56 B9R1.11 COC(=O)[C@@H]1CCCN1 4H58-5-X8 [1,0,0,1,0,0|1,0,0]=3 57 B9R1.11 COC(=O)[C@H]1CCCN1 4H56-5-R5 [1,0,0,1,0,0|1,0,0]=3 58 B9R1.82 COC(=O)C1CC(Cl)C1 2223-5-09 [1,0,0,1,0,0|2,0,0]=4 59 B9R1.82 COC(=O)C1CC(O)C1 2229-1-28 [1,0,0,1,0,0|2,0,0]=4 60 B9R1.82 COC(=O)[C@H]1C[C@H](O)C1 2229-1-35 [1,0,0,1,0,0|2,0,0]=4 61 B9R1.10 CC1(C)C=CC(=O)CC1 2417-1-02 [1,0,0,1,0,0|1,0,1]=4 62 B9R1.10 CC1(C)CCC(=O)CC1 G311-A-56 [1,0,0,1,0,0|1,0,0]=3 63 B9R1.35 CC(C)[C@@H]1COC(=O)N1 4H48-1-R4 [1,0,0,1,0,0|1,0,0]=3 64 B9R1.35 [C@H]1(C(C)C)COC(=O)N1 4H56-1-7T [1,0,0,1,0,0|1,0,0]=3 65 B9R1.164 CC1(C)CC(C(=O)O)C1 2221-1-27 [1,0,0,1,0,0|1,0,0]=3 66 B11R1.22 COC(=O)C1CCC(O)CC1 2229-1-X1 [0,0,0,1,0,1|2,0,0]=4 67 B11R1.22 COC(=O)[C@H]1CC[C@@H](N)CC1 4258-5-12 [0,0,0,1,0,1|2,0,0]=4 68 B11R1.22 COC(=O)[C@H]1CC[C@H](N)CC1 4258-5-02 [0,0,0,1,0,1|2,0,0]=4 69 B11R1.866 COC(=O)[C@@H]1COC(C)(C)O1 2H10-1-0E [0,0,0,1,0,1|0,0,0]=2 70 B7R0.16 CC(C)[C@H](O)C(=O)O 2129-1-S3 [1,0,0,0,1,0|0,0,0]=2 71 B7R0.16 CC(F)C(N)C(=O)O 4157-3-20 [1,0,0,0,1,0|2,0,0]=4 72 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O 4157-1-35 [1,0,0,0,1,0|2,0,0]=4 73 B9R0.1 COC(=O)CCCC(C)=O 2129-1-1R [1,0,0,0,0,1|1,0,1]=4 74 B9R0.1 COC(=O)\C=C\CC(C)C 2323-1-X4 [1,0,0,0,0,1|0,0,1]=3