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Substance Name: 5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 7-((aminophenylacetyl)amino)-3-methoxy-8-oxo-, (6R-(6-alpha,7-beta(R*)))-
RN: 51762-17-5
InChIKey: RASPLVISAYEZCJ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H17-N3-O5-S

Molecular Weight

  • 363.3923
 
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Names and Synonyms

Synonym

  • 7-beta-(D-alpha-Amino-alpha-phenylacetylamino)-3-methoxy-3-cephem-4-carboxylic acid

Systematic Name

  • 5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 7-((aminophenylacetyl)amino)-3-methoxy-8-oxo-, (6R-(6-alpha,7-beta(R*)))-

Registry Numbers

CAS Registry Number

  • 51762-17-5

System Generated Number

  • 0051762175

Structure Descriptors

InChI

1S/C16H17N3O5S/c1-24-9-7-25-15-11(14(21)19(15)12(9)16(22)23)18-13(20)10(17)8-5-3-2-4-6-8/h2-6,10-11,15H,7,17H2,1H3,(H,18,20)(H,22,23)

InChIKey

RASPLVISAYEZCJ-UHFFFAOYSA-N

Smiles

COC1=C(N2C(C(C2=O)NC(=O)C(c3ccccc3)N)SC1)C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 3800mg/kg (3800mg/kg)   United States Patent Document. Vol. #4073902,
mouse LD50 oral > 6gm/kg (6000mg/kg)   United States Patent Document. Vol. #4073902,