Cephalothin sodium

C16H15N2NaO6S2CAS 58-71-9418.41 g/mol

OOSNHOSONO−ONa+
AlkeneAmideCarboxylic acidEsterLactamSulfide

Properties

Molecular formula
C16H15N2NaO6S2
Molar mass
418.41 g/mol
Exact mass
418.0269 Da
Melting point
204.5 °C
logP
1.05Crippen estimate
Polar surface area
116.5 Ų
H-bond donors / acceptors
2 / 7
Rotatable bonds
6
Stereocentres
R, 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
58-71-9
SMILES
CC(=O)OCC=1CS[C@@H]2[C@H](NC(=O)Cc3cccs3)C(=O)N2C1C([O-])=O.[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

28 names · show all
  • 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 3-[(acetyloxy)methyl]-8-oxo-7-[[2-(2-thienyl)acetyl]amino]-, sodium salt (1:1), (6R,7R)-
  • 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 3-(hydroxymethyl)-8-oxo-7-[2-(2-thienyl)acetamido]-, acetate (ester), monosodium salt
  • 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 3-[(acetyloxy)methyl]-8-oxo-7-[(2-thienylacetyl)amino]-, monosodium salt, (6R-trans)-
  • 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 3-[(acetyloxy)methyl]-8-oxo-7-[(2-thienylacetyl)amino]-, monosodium salt, (6R,7R)-
  • 38253
  • Sodium cephalothin
  • Sodium cephalotin
  • Sodium 3-acetoxymethyl-7β-(2-thienylacetamido)ceph-3-em-4-carboxylate
  • Sodium 7-(2-thienylacetamido)-3-acetoxymethyl-3-cephem-4-carboxylate
  • Sodium (thienylacetamido)cephalosporanate
  • Sodium 7-[2-(2-thienyl)acetamido]cephalosporanate
  • Keflin
  • Lilly 38253
  • Microtin
  • Cefalothine sodium
  • Cefalothin sodium
  • Cepovenin
  • Ceporacin
  • Seffin
  • Cephalothin sodium salt
  • Sodium cefalotin
  • Synclotin
  • Cephation
  • Lospoven
  • Coaxin
  • Averon 1
  • Toricelocin
  • Cemastin

Work with Cephalothin 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