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Substance Name: 1-Azabicyclo(3.2.0)hept-2-ene-2-carboxylic acid, 3-((1-acetyl-4-piperidinyl)thio)-6-(1-hydroxyethyl)-7-oxo-, (5R-(5-alpha,6-alpha(R*)))-
RN: 145697-93-4
InChIKey: RDJMXRLDENENAD-XTWCZFFVSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H22-N2-O5-S

Molecular Weight

  • 354.4248
 
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Names and Synonyms

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

Registry Numbers

CAS Registry Number

  • 145697-93-4

System Generated Number

  • 0145697934

Structure Descriptors

InChI

1S/C16H22N2O5S/c1-8(19)13-11-7-12(14(16(22)23)18(11)15(13)21)24-10-3-5-17(6-4-10)9(2)20/h8,10-11,13,19H,3-7H2,1-2H3,(H,22,23)/t8-,11-,13-/m1/s1

InChIKey

RDJMXRLDENENAD-XTWCZFFVSA-N

Smiles

C[C@H]([C@@H]1[C@H]2CC(=C(N2C1=O)C(=O)O)SC3CCN(CC3)C(=O)C)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous > 12mg/kg (12mg/kg)   Journal of Antibiotics. Vol. 45, Pg. 1983, 1992.