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Substance Name: Metoprolol acid
RN: 56392-14-4
UNII: Y6I8U8OX8P
InChIKey: PUQIRTNPJRFRCZ-UHFFFAOYSA-N

Note

  • Pharmacologically inactive urinary metoprolol metabolite.

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H21-N-O4

Molecular Weight

  • 267.323
 
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Names and Synonyms

Results Name

  • Metoprolol acid

Name of Substance

  • H117-04

Synonyms

  • 4-(2-Hydroxy-3-((1-methylethyl)amino)propoxy)benzeneacetic acid
  • Atenolol acid
  • H 117/04
  • Metoprolol acid
  • SL 77-010
  • UNII-Y6I8U8OX8P

Systematic Name

  • Benzeneacetic acid, 4-(2-hydroxy-3-((1-methylethyl)amino)propoxy)-

Registry Numbers

CAS Registry Number

  • 56392-14-4

FDA UNII

  • Y6I8U8OX8P

System Generated Number

  • 0056392144

Structure Descriptors

InChI

1S/C14H21NO4/c1-10(2)15-8-12(16)9-19-13-5-3-11(4-6-13)7-14(17)18/h3-6,10,12,15-16H,7-9H2,1-2H3,(H,17,18)

InChIKey

PUQIRTNPJRFRCZ-UHFFFAOYSA-N

Smiles

c1(ccc(CC(O)=O)cc1)OC[C@@H](CNC(C)C)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
dog LD50 intravenous > 500mg/kg (500mg/kg)   Pharmacological and Biochemical Properties of Drug Substances. Vol. 2, Pg. 186, 1979.