Ceftizoxime sodium

C13H12N5NaO5S2CAS 68401-82-1405.38 g/mol

Open in Covalent MOL file
ONOHNONO−OSSNH2NNa+
AlkeneAmideCarboxylic acidLactamOximePrimary amineSulfide

Properties

Molecular formula
C13H12N5NaO5S2
Molar mass
405.38 g/mol
Exact mass
405.0178 Da
logP
-4.89Crippen estimate
Polar surface area
150.0 Ų
H-bond donors / acceptors
2 / 10
Rotatable bonds
5
Stereocentres
R, Rin SMILES atom order
Double bonds
ZE/Z, in SMILES order

Hazards

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

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Identifiers

CAS number
68401-82-1
SMILES
CO/N=C(\C(=O)N[C@@H]1C(=O)N2C(C([O-])=O)=CCS[C@H]12)c1csc(N)n1.[Na+]
InChIKey
ADLFUPFRVXCDMO-LIGXYSTNSA-M
InChI
InChI=1S/C13H13N5O5S2.Na/c1-23-17-7(5-4-25-13(14)15-5)9(19)16-8-10(20)18-6(12(21)22)2-3-24-11(8)18;/h2,4,8,11H,3H2,1H3,(H2,14,15)(H,16,19)(H,21,22);/q;+1/p-1/b17-7-;/t8-,11-;/m1./s1

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Names and synonyms

12 names
  • 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 7-[[(2Z)-2-(2-amino-4-thiazolyl)-2-(methoxyimino)acetyl]amino]-8-oxo-, sodium salt (1:1), (6R,7R)-
  • 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 7-[[(2-amino-4-thiazolyl)(methoxyimino)acetyl]amino]-8-oxo-, monosodium salt, [6R-[6α,7β(Z)]]-
  • 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 7-[[(2Z)-(2-amino-4-thiazolyl)(methoxyimino)acetyl]amino]-8-oxo-, monosodium salt, (6R,7R)-
  • FK 749
  • Sodium 7-[2-(2-aminothiazol-4-yl)-2-methoxyiminoacetamido]-3-cephem-4-carboxylate
  • Ceftizoxime sodium salt
  • Ceftix
  • Eposerin
  • Cefizox
  • Ceftizon
  • SKF 88373
  • FR 13479

Work with Ceftizoxime sodium

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

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.

Ceftizoxime68401-81-0Free acid

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Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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