Sodium 1-C-{4-[(R)-[(3R)-3-({2-[4-(3-amino-3-carboxylatopropoxy)phenyl]-1-oxidanidyl-2-[(oxidomethylidene)amino]ethylidene}amino)-2-oxoazetidin-1-yl](carboxy)methyl]phenyl}-beta-D-glucopyranuronic acid--water (3/1/2)

化合物标识与属性

CAS

104265-79-4

PubChem CID

138396884

SMILES

C1[C@H](C(=O)N1[C@H](C2=CC=C(C=C2)[C@@]3([C@@H]([C@H]([C@@H]([C@H](O3)C(=O)O)O)O)O)O)C(=O)O)N=C(C(C4=CC=C(C=C4)OCCC(C(=O)[O-])N)N=C[O-])[O-].O.O.[Na+].[Na+].[Na+]

Canonical SMILES

NC(CCOc1ccc(C(N=C[O-])C([O-])=N[C@@H]2CN([C@@H](C(=O)O)c3ccc([C@@]4(O)O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]4O)cc3)C2=O)cc1)C(=O)[O-].O.O.[Na+].[Na+].[Na+]