0 B9R0.39 CC(=O)N[C@@H](CS)C(=O)O 8158-1-X1 [0,0,0,0,0,0|0,0,0]=0 1 B8R0.23 CC(=O)N[C@@H](C)C(=O)O 4158-1-S9 [1,0,0,0,0,0|0,0,0]=1 2 B8R0.23 CC(=O)N[C@H](C)C(=O)O 4158-1-59 [1,0,0,0,0,0|0,0,0]=1 3 B8R0.23 CC(=O)O[C@@H](C)C(=O)Cl 2123-5-S0 [1,0,0,0,0,0|2,0,0]=3 4 B8R0.23 O=C(O)C[C@@H](O)C(=O)O 2129-1-49 [1,0,0,0,0,0|2,1,0]=4 5 B10R1.113 O=C1CCC[C@@H](C(=O)O)N1 4H58-1-S05 [0,0,0,1,0,0|1,0,0]=2 6 B10R1.361 O=C(O)[C@H]1CC[C@@H]1C(=O)O 2221-1-E1 [0,0,0,1,0,0|3,0,0]=4 7 B7R0.6 CC(=O)CCC(C)=O 2118-1-25 [2,0,0,0,0,0|2,0,0]=4 8 B7R0.6 CC(=O)OCC(=O)Cl 2129-5-X0 [2,0,0,0,0,0|2,0,0]=4 9 B7R0.6 N=C(N)NCC(=O)O 4156-1-60 [2,0,0,0,0,0|2,0,0]=4 10 B9R0.33 CC(C)[C@H](NC=O)C(=O)O 4H58-1-7E [1,1,0,0,0,0|1,0,0]=3 11 B9R0.11 CC(=O)OC(C)(C)C(=O)Br 2123-9-0Q [1,1,0,0,0,0|2,0,0]=4 12 B9R0.11 CC(C)(CC(=O)O)C(=O)O 2121-1-16 [1,1,0,0,0,0|2,0,0]=4 13 B9R0.42 COC(=O)C[C@H](N)C(=O)O 4157-5-S2 [1,1,0,0,0,0|2,0,0]=4 14 B11R0.236 CCCC(NC(=O)CCl)C(=O)O 4157-5-0F [0,2,0,0,0,0|1,0,0]=3 15 B9R1.6 O=C(O)C1CCCCN1 4H57-1-W5 [1,0,0,1,0,0|1,0,1]=4 16 B9R1.6 O=C(O)C1CCCCN1 4H58-5-BW [1,0,0,1,0,0|1,0,1]=4 17 B9R1.6 O=C(O)C1CSCCN1 8H21-1-Y5 [1,0,0,1,0,0|0,0,1]=3 18 B9R1.6 O=C(O)[C@@H]1CNCCN1 4H21-1-S2 [1,0,0,1,0,0|1,0,1]=4 19 B9R1.6 O=C(O)[C@@H]1CNCCN1 G311-A-13 [1,0,0,1,0,0|1,0,1]=4 20 B9R1.6 O=C(O)[C@H]1CCCCN1 4H58-1-RE [1,0,0,1,0,0|1,0,1]=4 21 B9R1.6 O=C(O)[C@H]1CNCCN1 4H21-5-Z4 [1,0,0,1,0,0|1,0,1]=4 22 B9R1.6 O=C(O)[C@H]1COCCN1 4H58-5-R9 [1,0,0,1,0,0|0,1,1]=4 23 B9R1.35 O=C1CC(C(=O)O)CN1 4H58-1-24 [1,0,0,1,0,0|2,0,0]=4 24 B9R1.35 O=C1CC[C@@H](C(=O)O)N1 4H56-1-5D [1,0,0,1,0,0|1,0,0]=3 25 B9R1.35 O=C1CC[C@@H](C(=O)O)O1 2H25-1-S1 [1,0,0,1,0,0|2,0,0]=4 26 B9R1.35 O=C1CC[C@H](C(=O)O)N1 4H57-1-R1 [1,0,0,1,0,0|1,0,0]=3 27 B9R1.168 NC(=O)C1(C(=O)O)CC1 4H48-1-QM [0,0,0,1,1,0|2,0,0]=4 28 B9R1.168 O=C(O)C1(C(=O)O)CC1 2221-1-11 [0,0,0,1,1,0|2,0,0]=4 29 B11R1.74 O=C1CC(=O)CC(C(=O)O)C1 2229-1-X6 [0,1,0,1,0,0|1,1,0]=4 30 B11R1.21 CN1CCC(C(=O)O)CC1=O 4H58-1-8U [0,1,0,1,0,0|2,0,0]=4 31 B7R0.16 CC(=O)C(Cl)C(C)=O 2118-5-01 [1,0,0,0,1,0|2,0,0]=4 32 B9R0.53 CC(=O)OC(C)OC(C)=O 2123-1-1K [1,0,0,0,0,1|2,0,0]=4