Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 7-(((2-amino-4-thiazolyl)((1-carboxy-1-methylethoxy)imino)acetyl)amino)-3-(2-(1,4-dihydro-1,5-dihydroxy-4-oxo-2-pyridinyl)ethenyl)-8-oxo-, trisodium salt, (6R-(3(Z),6-alpha,7-beta(Z)))-
RN: 132182-69-5
InChIKey: BOHNOJLLRPDBJU-VFBCSPMQSA-K

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H22-N6-O10-S2.3Na

Molecular Weight

  • 672.5371
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

  • 5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 7-(((2-amino-4-thiazolyl)((1-carboxy-1-methylethoxy)imino)acetyl)amino)-3-(2-(1,4-dihydro-1,5-dihydroxy-4-oxo-2-pyridinyl)ethenyl)-8-oxo-, trisodium salt, (6R-(3(Z),6-alpha,7-beta(Z)))-

Registry Numbers

CAS Registry Number

  • 132182-69-5

System Generated Number

  • 0132182695

Molecular Formulas

Molecular Formula

  • C23-H22-N6-O10-S2.3Na

Molecular Formula Fragments

  • C23-H22-N6-O10-S2
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C23H22N6O10S2.3Na/c1-23(2,21(36)37)39-27-14(11-8-41-22(24)25-11)17(32)26-15-18(33)29-16(20(34)35)9(7-40-19(15)29)3-4-10-5-12(30)13(31)6-28(10)38;;;/h3-6,8,15,19,31,38H,7H2,1-2H3,(H2,24,25)(H,26,32)(H,34,35)(H,36,37);;;/q;3*+1/p-3/b4-3+,27-14+;;;

InChIKey

BOHNOJLLRPDBJU-VFBCSPMQSA-K

Smiles

CC(C)(C(=O)[O-])O/N=C(\c1csc(n1)N)/C(=O)NC2C3N(C2=O)C(=C(CS3)/C=C/c4cc(=O)c(cn4O)[O-])C(=O)[O-].[Na+].[Na+].[Na+]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intravenous > 2gm/kg (2000mg/kg)   Journal of Antibiotics. Vol. 43, Pg. 1450, 1990.