0 B9R0.7 CC(=O)OC[C@H](N)C(O)=O HY-101409 [0,0,0,0,0,0|2,0,0]=2 1 B9R0.7 NC(CCC(N)=O)C(O)=O HY-B1346 [0,0,0,0,0,0|0,0,0]=0 2 B9R0.7 N[C@@H](CCC(N)=O)C(O)=O HY-N0390 [0,0,0,0,0,0|0,0,0]=0 3 B9R0.7 N[C@H](CCC(N)=O)C(O)=O HY-100587 [0,0,0,0,0,0|0,0,0]=0 4 B9R0.7 N[C@H](CCC(O)=O)C(O)=O AC510929 [0,0,0,0,0,0|1,0,0]=1 5 B9R0.7 N[C@H](CCC(O)=O)C(O)=O HY-100805 [0,0,0,0,0,0|1,0,0]=1 6 B9R0.7 O[C@H](CCC([O-])=O)C([O-])=O HY-100542 [0,0,0,0,0,0|2,0,1]=3 7 B8R0.8 C[Se]CCC(N)C(O)=O HY-B1000 [1,0,0,0,0,0|2,0,0]=3 8 B8R0.8 C[Se]CC[C@H](N)C(O)=O HY-B1000A [1,0,0,0,0,0|2,0,0]=3 9 B8R0.8 NCCC[C@H](N)C(O)=O HY-B1352 [1,0,0,0,0,0|0,0,1]=2 10 B8R0.9 NC(CCC(O)=O)C=C HY-15399 [1,0,0,0,0,0|2,0,0]=3 11 B8R0.9 NC(CCC(O)=O)C=C HY-B0033 [1,0,0,0,0,0|2,0,0]=3 12 B8R0.28 CC(=O)CCCC(O)=O AC180079 [1,0,0,0,0,0|1,0,0]=2 13 B8R0.28 CN(C)CCCC(O)=O AC130623 [1,0,0,0,0,0|3,0,0]=4 14 B10R0.43 OC(=O)CCC(F)(F)C(O)=O AC160417 [0,1,0,0,0,0|2,0,0]=3 15 B10R0.82 COC(=O)CC[C@H](N)C(O)=O AC511522 [0,1,0,0,0,0|1,0,0]=2 16 B10R0.82 N[C@@H](CS/C(Cl)=C\Cl)C(O)=O HY-19717 [0,1,0,0,0,0|3,0,0]=4 17 B10R1.13 OC(=O)C1CCC(=O)CC1 AC511132 [0,0,0,1,0,0|2,0,0]=3 18 B10R1.13 OC(=O)C1CCC(=O)CN1 AC160004 [0,0,0,1,0,0|1,0,0]=2 19 B8R0.23 CC(C)C[C@@H](N)C(O)=O AC180566 [0,0,0,0,1,0|2,0,1]=4 20 B8R0.23 C[C@@H](CC(=O)O)C(=O)O LN01743142 [0,0,0,0,1,0|2,0,0]=3 21 B8R0.23 C[C@H](NC(C)=O)C(O)=O AC190198 [0,0,0,0,1,0|3,0,0]=4 22 B8R0.23 C[C@H](OC(C)=O)C(O)=O AC020546 [0,0,0,0,1,0|3,0,0]=4 23 B8R0.23 O[C@H](CC(O)=O)C(O)=O AC180071 [0,0,0,0,1,0|2,0,0]=3 24 B7R0.4 COCCCC(O)=O AC100091 [2,0,0,0,0,0|2,0,0]=4 25 B7R0.5 CCC[C@H](N)C(O)=O AC180580 [2,0,0,0,0,0|0,0,1]=3 26 B7R0.5 COC[C@@H](N)C(O)=O AC021210 [2,0,0,0,0,0|1,0,1]=4 27 B7R0.5 COC[C@H](N)C(O)=O AC511991 [2,0,0,0,0,0|1,0,1]=4 28 B7R0.5 NC(CCO)C(O)=O AC511583 [2,0,0,0,0,0|0,0,1]=3 29 B7R0.5 NCCC(N)C(O)=O AC511576 [2,0,0,0,0,0|0,0,0]=2 30 B7R0.5 NCC[C@H](N)C(O)=O HY-101414 [2,0,0,0,0,0|0,0,0]=2 31 B7R0.5 NCC[C@H](O)C(O)=O AC181087 [2,0,0,0,0,0|1,0,0]=3 32 B7R0.5 N[C@@H](CC#C)C(O)=O AC030195 [2,0,0,0,0,0|0,0,2]=4 33 B7R0.5 N[C@@H](CCO)C(O)=O AC180567 [2,0,0,0,0,0|0,0,1]=3 34 B9R0.47 CCCCC[C@H](N)C(O)=O AC512037 [1,1,0,0,0,0|1,0,1]=4 35 B9R0.47 NCCCC[C@@H](N)C(O)=O AC180292 [1,1,0,0,0,0|0,0,1]=3 36 B9R0.47 NCCOC[C@H](N)C(O)=O HY-U00097 [1,1,0,0,0,0|0,0,1]=3 37 B9R0.47 N[C@@H](CSCC#C)C(O)=O AC160392 [1,1,0,0,0,0|1,0,1]=4 38 B9R0.53 CN(CC(O)=O)CC(O)=O AC511698 [1,1,0,0,0,0|2,0,0]=4 39 B9R0.53 OC(=O)CS(=O)CC(O)=O AC010141 [1,1,0,0,0,0|2,0,0]=4 40 B9R0.39 CN[C@H](CC(O)=O)C(O)=O HY-17551 [0,1,0,0,1,0|1,0,0]=3 41 B9R0.79 O[C@H]([C@@H](O)C(O)=O)C(O)=O HY-D0850 [0,1,0,0,1,0|2,0,0]=4 42 B11R0.141 N[C@@H](COC(=O)C=[N+]=[N-])C(O)=O HY-B0919 [0,2,0,0,0,0|1,0,1]=4 43 B9R1.6 OC(=O)C1CCCCN1 AC130051 [1,0,0,1,0,0|1,0,1]=4 44 B9R1.6 OC(=O)C1CCCCN1 AC510756 [1,0,0,1,0,0|1,0,1]=4 45 B9R1.6 OC(=O)[C@@H]1CCC=CC1 AC310100 [1,0,0,1,0,0|2,0,0]=4 46 B9R1.6 OC(=O)[C@H]1CCC=CC1 AC310113 [1,0,0,1,0,0|2,0,0]=4 47 B9R1.6 OC(=O)[C@H]1CCCCN1 AC180578 [1,0,0,1,0,0|1,0,1]=4 48 B9R1.35 OC(=O)C1CCC(=O)C1 AC160621 [1,0,0,1,0,0|1,0,0]=3 49 B9R1.35 OC(=O)C1CCC(=O)N1 AC511521 [1,0,0,1,0,0|0,0,0]=2 50 B9R1.35 OC(=O)[C@@H]1CCC(=O)N1 AC190184 [1,0,0,1,0,0|0,0,0]=2 51 B9R1.35 OC(=O)[C@H]1CCC(=O)N1 AC180591 [1,0,0,1,0,0|0,0,0]=2 52 B9R1.110 NC(C1CCC1)C(O)=O AC050494 [1,0,0,1,0,0|1,0,1]=4 53 B9R1.110 N[C@H](C1CCC1)C(O)=O AC050744 [1,0,0,1,0,0|1,0,1]=4 54 B9R1.163 C1COCC1(C(=O)O)N LN00170684 [1,0,0,1,0,0|2,0,0]=4 55 B9R1.163 C[C@@]1(CCCN1)C(=O)O LN00231771 [1,0,0,1,0,0|1,0,1]=4 56 B9R1.163 C[C@@]1(CCCN1)C(O)=O AC021002 [1,0,0,1,0,0|1,0,1]=4 57 B9R1.163 C[C@]1(CCCN1)C(O)=O AC020387 [1,0,0,1,0,0|1,0,1]=4 58 B9R1.163 C[C@]1(CCCN1)C(O)=O AC021246 [1,0,0,1,0,0|1,0,1]=4 59 B9R1.163 NC1(CCCC1)C(O)=O AC511825 [1,0,0,1,0,0|1,0,1]=4 60 B9R1.163 NC1(CCNC1)C(O)=O AC021073 [1,0,0,1,0,0|2,0,0]=4 61 B9R1.53 CC(=O)OC1CC(=O)N1 AC280001 [1,0,0,1,0,0|2,0,0]=4 62 B11R1.175 OC(=O)C1CCC(C1)C(O)=O AC181312 [0,0,0,1,0,1|2,0,0]=4 63 B11R1.175 OC(=O)[C@@H]1CN[C@@H](C1)C(O)=O AC021060 [0,0,0,1,0,1|2,0,0]=4 64 B11R1.22 COC(=O)C1CCC(=O)CC1 AC511973 [0,1,0,1,0,0|2,0,0]=4 65 B7R0.16 NC(C(N)=O)C(N)=O AC180316 [0,0,0,0,2,0|1,0,0]=3 66 B9R0.55 CC(=O)NCCCC(O)=O HY-101411 [1,0,0,0,0,1|1,0,0]=3 67 B11R0.29 C(C[C@H](C(=O)O)N)CNC(=N)N LN00145741 [0,0,0,0,0,2|1,0,0]=3 68 B11R0.29 N[C@@H](CCCNC(N)=N)C(O)=O HY-N0455 [0,0,0,0,0,2|1,0,0]=3 69 B11R0.29 N[C@@H](CCCNC(N)=N)C(O)=O HY-N0455A [0,0,0,0,0,2|1,0,0]=3