0  B16R2.671719  CC1(C(N2C(=O)CC2S1(=O)=O)C(=O)O)C Molport-005-933-282 [0,0,0,0,0,0|0,0,0]=0
1  B16R2.671719  CC1(C(N2C(=O)CC2S1(=O)=O)C(=O)[O-])C Molport-002-338-764 [0,0,0,0,0,0|0,0,1]=1
2  B16R2.671719  CC1([C@@H](N2C(=O)CC2S1(=O)=O)C(=O)[O-])C Molport-002-507-463 [0,0,0,0,0,0|0,0,1]=1
3  B18R2.5437878  CC1(C(N2C(=O)C(C2S1(=O)=O)(Br)Br)C(=O)[O-])C Molport-000-707-898 [0,2,0,0,0,0|0,0,1]=3
4  B14R0.399  CC(C)C(NC(=O)CCC(=O)O)C(=O)O Molport-001-632-017 [0,0,2,0,0,0|1,0,1]=4