Benanomicin A 4'''-sulfate

Compound Identifiers & Properties

PubChem CID

101613791

SMILES

C[C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)O[C@@H]2[C@H](C3=CC4=C(C(=C3C5=C2C=C(C(=C5O)C(=O)N[C@H](C)C(=O)O)C)O)C(=O)C6=C(C4=O)C(=CC(=C6)OC)[O-])O)O)O[C@H]7[C@@H]([C@H]([C@@H](CO7)OS(=O)(=O)O)O)O)O.[Na+]

Canonical SMILES

COc1cc([O-])c2c(c1)C(=O)c1c(cc3c(c1O)-c1c(cc(C)c(C(=O)N[C@H](C)C(=O)O)c1O)[C@H](O[C@@H]1O[C@H](C)[C@H](O)[C@H](O[C@@H]4OC[C@@H](OS(=O)(=O)O)[C@H](O)[C@H]4O)[C@H]1O)[C@H]3O)C2=O.[Na+]