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Substance Name: 1-Azabicyclo(3.2.0)hept-2-ene-2-carboxylic acid, 6-(1-hydroxyethyl)-7-oxo-3-(4-pyridinylthio)-, (5R-(5-alpha,6-alpha(R*)))-
RN: 81520-91-4
InChIKey: BHPPSVRPJRLQNG-BCMRRPTOSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H14-N2-O4-S

Molecular Weight

  • 306.3406
 
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Names and Synonyms

  • 1-Azabicyclo(3.2.0)hept-2-ene-2-carboxylic acid, 6-(1-hydroxyethyl)-7-oxo-3-(4-pyridinylthio)-, (5R-(5-alpha,6-alpha(R*)))-

Registry Numbers

CAS Registry Number

  • 81520-91-4

System Generated Number

  • 0081520914

Structure Descriptors

InChI

1S/C14H14N2O4S/c1-7(17)11-9-6-10(21-8-2-4-15-5-3-8)12(14(19)20)16(9)13(11)18/h2-5,7,9,11,17H,6H2,1H3,(H,19,20)/t7-,9-,11-/m1/s1

InChIKey

BHPPSVRPJRLQNG-BCMRRPTOSA-N

Smiles

C[C@H]([C@@H]1[C@H]2CC(=C(N2C1=O)C(=O)O)Sc3ccncc3)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 parenteral 3320ug/kg (3.32mg/kg)   Journal of Antibiotics. Vol. 45, Pg. 1983, 1992.