0  B29R3.60360606  C\C=C\C1=C(N2[C@@H]([C@@H](C2=O)NC(=O)[C@@H](c3ccc(cc3)O)N)SC1)C(=O)O CHEBI:3506 [0,0,0,0,0,0|0,0,0]=0
1  B27R3.368466829  CC1=C(N2[C@@H]([C@@H](C2=O)NC(=O)[C@@H](c3ccc(cc3)O)N)SC1)C(=O)O CHEBI:3479 [2,0,0,0,0,0|0,0,0]=2
2  B27R3.368466829  CC1=C(N2[C@@H]([C@@H](C2=O)NC(=O)[C@@H](c3ccc(cc3)O)N)SC1)C(=O)O CHEBI:53667 [2,0,0,0,0,0|0,0,0]=2
3  B27R3.368466829  CC1=C(N2[C@@H]([C@@H](C2=O)NC(=O)[C@@H](c3ccc(cc3)O)N)SC1)C(=O)[O-] CHEBI:53669 [2,0,0,0,0,0|0,0,1]=3