Heparin disaccharide i-a sodium

Compound Identifiers & Properties

CAS

136098-00-5

PubChem CID

177699450

SMILES

CC(=O)N[C@@H](C=O)[C@H]([C@@H]([C@@H](COS(=O)(=O)[O-])O)O[C@H]1[C@@H]([C@H](C=C(O1)C(=O)[O-])O)OS(=O)(=O)[O-])O.[Na+].[Na+].[Na+]

Canonical SMILES

CC(=O)N[C@@H](C=O)[C@@H](O)[C@H](O[C@@H]1OC(C(=O)[O-])=C[C@H](O)[C@H]1OS(=O)(=O)[O-])[C@H](O)COS(=O)(=O)[O-].[Na+].[Na+].[Na+]