Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Pyridinium, 1-((7-(((2-amino-4-thiazolyl)(methoxyimino)acetyl)amino)-2-carboxy-8-oxo-5-thia-1-azabicyclo(4.2.0)oct-2-en-3-yl)methyl)-4-(1,3,4-oxadiazol-2-yl)-, hydroxide, inner salt, (6R-(6-alpha,7-beta(Z)))-, hydrate (2:5)
RN: 102189-79-7
InChIKey: AMYLMCBJUWBYEW-SDTDGSPXSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H18-N8-O6-S2.5/2H2-O

Molecular Weight

  • 1175.1844
 
* 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

  • Pyridinium, 1-((7-(((2-amino-4-thiazolyl)(methoxyimino)acetyl)amino)-2-carboxy-8-oxo-5-thia-1-azabicyclo(4.2.0)oct-2-en-3-yl)methyl)-4-(1,3,4-oxadiazol-2-yl)-, hydroxide, inner salt, (6R-(6-alpha,7-beta(Z)))-, hydrate (2:5)

Registry Numbers

CAS Registry Number

  • 102189-79-7

System Generated Number

  • 0102189797

Molecular Formulas

Molecular Formula

  • C21-H18-N8-O6-S2.5/2H2-O

Molecular Formula Fragments

  • C21-H18-N8-O6-S2
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/2C21H18N8O6S2.5H2O/c2*1-34-27-13(12-8-37-21(22)24-12)16(30)25-14-18(31)29-15(20(32)33)11(7-36-19(14)29)6-28-4-2-10(3-5-28)17-26-23-9-35-17;;;;;/h2*2-5,8-9,14,19H,6-7H2,1H3,(H3-,22,24,25,30,32,33);5*1H2/b2*27-13+;;;;;/t2*14-,19-;;;;;/m00...../s1

InChIKey

AMYLMCBJUWBYEW-SDTDGSPXSA-N

Smiles

CO/N=C(/C(=O)N[C@H]1C(=O)N2[C@H]1SCC(=C2C(=O)[O-])C[n+]3ccc(cc3)c4ocnn4)\c5nc(sc5)N.CO/N=C(/C(=O)N[C@H]1C(=O)N2[C@H]1SCC(=C2C(=O)[O-])C[n+]3ccc(cc3)c4ocnn4)\c5nc(sc5)N.O.O.O.O.O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous > 4gm/kg (4000mg/kg)   Journal of Antibiotics. Vol. 40, Pg. 43, 1987.