Cefminox sodium

C16H20N7NaO7S3CAS 75498-96-3541.55 g/mol

ONHOSH2NO−OONOOHSNNNNSNa+
AlkeneAmideCarboxylic acidEtherLactamPrimary amineSulfide

Properties

Molecular formula
C16H20N7NaO7S3
Molar mass
541.55 g/mol
Exact mass
541.0484 Da
Melting point
90–91 °C
logP
-1.38Crippen estimate
Polar surface area
206.3 Ų
H-bond donors / acceptors
4 / 12
Rotatable bonds
11
Stereocentres
S, 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
75498-96-3
SMILES
CO[C@@]1(NC(=O)CSC[C@@H](N)C([O-])=O)C(=O)N2C(C(=O)O)=C(CSc3nnnn3C)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

5 names
  • 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 7-[[2-[[(2S)-2-amino-2-carboxyethyl]thio]acetyl]amino]-7-methoxy-3-[[(1-methyl-1H-tetrazol-5-yl)thio]methyl]-8-oxo-, sodium salt (1:1), (6R,7S)-
  • 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 7-[[[(2-amino-2-carboxyethyl)thio]acetyl]amino]-7-methoxy-3-[[(1-methyl-1H-tetrazol-5-yl)thio]methyl]-8-oxo-, monosodium salt, [6R-[6α,7α,7(S*)]]-
  • 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 7-[[[[(2S)-2-amino-2-carboxyethyl]thio]acetyl]amino]-7-methoxy-3-[[(1-methyl-1H-tetrazol-5-yl)thio]methyl]-8-oxo-, monosodium salt, (6R,7S)-
  • Meicelin
  • Cefminox sodium salt

Work with Cefminox 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