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Substance Name: 4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 3,3-dimethyl-6-(((4-methylphenoxy)acetyl)amino)-7-oxo-, monopotassium salt, (2S-(2-alpha,5-alpha,6-beta))-
RN: 15545-38-7
InChIKey: PFPWSNRLBGDFMQ-ZCGPAKHCSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H19-N2-O5-S.K

Molecular Weight

  • 402.5101
 
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Names and Synonyms

  • 4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 3,3-dimethyl-6-(((4-methylphenoxy)acetyl)amino)-7-oxo-, monopotassium salt, (2S-(2-alpha,5-alpha,6-beta))-

Registry Numbers

CAS Registry Number

  • 15545-38-7

System Generated Number

  • 0015545387

Molecular Formulas

Molecular Formula

  • C17-H19-N2-O5-S.K

Molecular Formula Fragments

  • C17-H19-N2-O5-S
  • COMPONENT
  • K

Structure Descriptors

InChI

1S/C17H20N2O5S.K/c1-9-4-6-10(7-5-9)24-8-11(20)18-12-14(21)19-13(16(22)23)17(2,3)25-15(12)19;/h4-7,12-13,15H,8H2,1-3H3,(H,18,20)(H,22,23);/q;+1/p-1/t12-,13+,15-;/m1./s1

InChIKey

PFPWSNRLBGDFMQ-ZCGPAKHCSA-M

Smiles

[K+].Cc1ccc(OCC(=O)N[C@H]2[C@H]3SC(C)(C)[C@@H](N3C2=O)C(=O)[O-])cc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intramuscular 1156mg/kg (1156mg/kg)   Polish Journal of Pharmacology and Pharmacy. Vol. 29, Pg. 39, 1977.
rat LD50 oral 1875mg/kg (1875mg/kg)   Polish Journal of Pharmacology and Pharmacy. Vol. 29, Pg. 39, 1977.