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Substance Name: 5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 3-((acetyloxy)methyl)-7-((cyanophenylacetyl)amino)-8-oxo-, sodium salt
RN: 33474-56-5
InChIKey: RAWZEWMKUXCOOP-FUCWVHJZSA-M

Molecular Formula

  • C19-H16-N3-O6-S.Na

Molecular Weight

  • 437.406
 
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Names and Synonyms

Synonyms

  • 41068A
  • 7-Phenylcyanacetylaminocephalosporanic acid
  • Acide 7-phenylcyanacetylamino-cephalosporanique sel de sodium
  • Acide 7-phenylcyanacetylamino-cephalosporanique sel de sodium [French]

Systematic Name

  • 5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 3-((acetyloxy)methyl)-7-((cyanophenylacetyl)amino)-8-oxo-, sodium salt

Registry Numbers

CAS Registry Number

  • 33474-56-5

System Generated Number

  • 0033474565

Molecular Formulas

Molecular Formula

  • C19-H16-N3-O6-S.Na

Molecular Formula Fragments

  • C19-H16-N3-O6-S
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C19H17N3O6S.Na/c1-10(23)28-8-12-9-29-18-14(17(25)22(18)15(12)19(26)27)21-16(24)13(7-20)11-5-3-2-4-6-11;/h2-6,13-14,18H,8-9H2,1H3,(H,21,24)(H,26,27);/q;+1/p-1/t13?,14-,18-;/m1./s1

InChIKey

RAWZEWMKUXCOOP-FUCWVHJZSA-M

Smiles

[Na+].N12C(=C(CS[C@@H]2[C@@H](C1=O)NC(=O)[C@@H](c1ccccc1)C#N)COC(=O)C)C(=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 500mg/kg (500mg/kg)   French Medicament Patent Document. Vol. #005300M,
mouse LD subcutaneous > 500mg/kg (500mg/kg)   French Medicament Patent Document. Vol. #005300M,