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Chemical structure of Cephradine monohydrate

GC25218

Cephradine monohydrate

Also known as (6R,7R)-7-[[(2R)-2-amino-2-cyclohexa-1,4-dien-1-ylacetyl]amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid;hydrate

Cefradine is a beta-lactam, first-generation cephalosporin antibiotic with bactericidal activity

ChemicalCAS75975-70-1MW367.42FormulaC16H19N3O4S·H2O
CAS number
75975-70-1
Molecular weight
367.42
Formula
C16H19N3O4S·H2O
Solubility
DMSO： Insoluble;Water： 4 mg/mL (10·89 mM);
InChIKey
VHNPSPMQGXQSET-CYJZLJNKSA-N
Catalogue number
GC25218
Brand
GLPBIO
Computed properties PubChem CID 21124775 · TPSA 139 Ų · H-bond donors 4 · H-bond acceptors 7
TPSA
139 Ų
H-bond donors
4
H-bond acceptors
7
Rotatable bonds
4
Heavy atoms
25

SMILES CC1=C(N2[C@@H]([C@@H](C2=O)NC(=O)[C@@H](C3=CCC=CC3)N)SC1)C(=O)O.O

Computed descriptors from PubChem (CID 21124775), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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