Cefoxitin sodium

C16H16N3NaO7S2CAS 33564-30-6449.43 g/mol

ONHOSONO−OONH2OSNa+
AlkeneAmideCarboxylic acidEtherLactamSulfide

Properties

Molecular formula
C16H16N3NaO7S2
Molar mass
449.43 g/mol
Exact mass
449.0327 Da
logP
0.97Crippen estimate
Polar surface area
152.7 Ų
H-bond donors / acceptors
4 / 8
Rotatable bonds
7
Stereocentres
S, Rin SMILES atom order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
33564-30-6
SMILES
CO[C@@]1(NC(=O)Cc2cccs2)C(=O)N2C(C([O-])=O)=C(COC(N)=O)CS[C@H]12.[Na+]
InChI

The InChI we hold for this record describes the parent acid and the metal separately rather than the salt above, so it is not shown here.

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Names and synonyms

15 names · show all
  • 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 3-[[(aminocarbonyl)oxy]methyl]-7-methoxy-8-oxo-7-[(2-thienylacetyl)amino]-, sodium salt (1:1), (6R,7S)-
  • 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 3-[[(aminocarbonyl)oxy]methyl]-7-methoxy-8-oxo-7-[(2-thienylacetyl)amino]-, monosodium salt, (6R-cis)-
  • 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 3-[[(aminocarbonyl)oxy]methyl]-7-methoxy-8-oxo-7-[(2-thienylacetyl)amino]-, monosodium salt, (6R,7S)-
  • Cefoxitin sodium salt
  • Cenomycin
  • Monosodium cefoxitin
  • Mefoxin
  • Merxin
  • Mefoxithin
  • Mefoxitin
  • MK 306
  • Farmoxin
  • Betacef
  • Cefaxilin sodium
  • Sodium cefoxitin

Work with Cefoxitin sodium

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Similar compounds

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere