0  B8R0.8  CCCC[C@@H](N)C(=O)O DB04419 [0,0,0,0,0,0|2,0,1]=3
1  B8R0.8  CSCCC(=O)C(=O)O DB02238 [0,0,0,0,0,0|2,0,0]=2
2  B8R0.8  CSCCC(N)C(=O)O DB13972 [0,0,0,0,0,0|3,0,1]=4
3  B8R0.8  CSCC[C@@H](N)C(=O)O DB02893 [0,0,0,0,0,0|3,0,1]=4
4  B8R0.8  N[C@@H](CCCO)C(=O)O DB03105 [0,0,0,0,0,0|3,0,1]=4
5  B7R0.3  [C@@H](N)(C=O)CCCC DB03241 [1,0,0,0,0,0|1,0,1]=3
6  B7R0.4  O=C(O)CCCCO DB04781 [1,0,0,0,0,0|2,0,1]=4
7  B7R0.4  [NH3+]CCCCC(=O)O DB02068 [1,0,0,0,0,0|2,0,1]=4
8  B7R0.5  C(C)=CC(=O)C(=O)O DB02005 [1,0,0,0,0,0|1,0,2]=4
9  B7R0.5  CCC[C@H](N)C(=O)O DB04185 [1,0,0,0,0,0|2,0,1]=4
10  B9R0.7  O=C(O)CCC(=O)C(=O)O DB08845 [0,1,0,0,0,0|2,0,1]=4
11  B9R0.47  NC(=O)[C@@H](N)CCCC[NH3+] DB03988 [0,1,0,0,0,0|2,0,1]=4
12  B9R0.47  NCCCC[C@@H](N)C(=O)O DB03252 [0,1,0,0,0,0|2,0,1]=4
13  B9R0.47  N[C@@H](CCCCO)C(=O)O DB03412 [0,1,0,0,0,0|2,0,1]=4
14  B9R0.47  [C@@H](N)(CCCCO)C(=O)O DB02233 [0,1,0,0,0,0|2,0,1]=4
15  B9R1.6  O=C(O)C1=CCCNC1 DB08848 [0,0,0,1,0,0|3,0,0]=4
16  B9R1.163  NC1(C(=O)O)CCCC1 DB04620 [0,0,0,1,0,0|2,0,1]=4
17  B6R0.1  CCNC(=O)OC DB03919 [2,0,0,0,0,0|2,0,0]=4
18  B6R0.1  CCOC(=O)NC DB02856 [2,0,0,0,0,0|2,0,0]=4
19  B6R0.4  CCCCC(=O)O DB02406 [2,0,0,0,0,0|0,0,1]=3
20  B6R0.4  CCCOC(C)=O DB01670 [2,0,0,0,0,0|1,0,0]=3
21  B6R0.3  CCC(=O)C(=O)O DB04553 [2,0,0,0,0,0|1,0,0]=3
22  B6R0.3  O=C(O)C(=O)CO DB02951 [2,0,0,0,0,0|2,0,0]=4
23  B8R0.7  CCCCCCC(=O)O DB02938 [1,1,0,0,0,0|1,0,1]=4
24  B8R0.7  CCCCCCC(N)=O DB02641 [1,1,0,0,0,0|1,0,1]=4
25  B8R0.23  CC(C)CC(=O)C(=O)O DB03229 [1,1,0,0,0,0|1,0,0]=3
26  B8R1.2  O=CN1CCCCC1 DB04113 [1,0,0,1,0,0|2,0,0]=4
27  B8R1.40  [C@@H](C)(C=O)CC1CC1 DB03736 [1,0,0,1,0,0|1,0,1]=4
28  B8R1.4  C[C@H]1CC=CC(=O)O1 DB14121 [1,0,0,1,0,0|1,0,1]=4
29  B8R1.7  O=C([O-])C1=[NH+]CCC1 DB02838 [1,0,0,1,0,0|2,0,0]=4
30  B10R1.113  CC(=O)N1CCC[C@@H](C)C1 DB01742 [0,1,0,1,0,0|2,0,0]=4