Disodium (8xi,9xi,14xi)-3alpha-hydroxy-N-(2-sulfonatoethyl)-7alpha-(sulfooxy)-5beta-cholan-24-imidate

化合物标识与属性

CAS

66874-12-2

PubChem CID

138401097

SMILES

C[C@H](CCC(=NCCS(=O)(=O)[O-])[O-])[C@H]1CCC2[C@@]1(CCC3C2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)OS(=O)(=O)O)C.[Na+].[Na+]

Canonical SMILES

C[C@H](CCC([O-])=NCCS(=O)(=O)[O-])[C@H]1CCC2C3C(CC[C@@]21C)[C@@]1(C)CC[C@@H](O)C[C@H]1C[C@H]3OS(=O)(=O)O.[Na+].[Na+]