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Substance Name: 2-Pyridinemethanol, alpha-(1-methyl-2-(methylphenethylamino)ethyl)-alpha-phenyl-, oxalate, hydrate (2:2:1)
RN: 4383-45-3
InChIKey: AUDOXLAQHZFHHE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H28-N2-O.C2-H2-O4.1/2H2-O

Molecular Weight

  • 450.532
 
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Names and Synonyms

  • 2-Pyridinemethanol, alpha-(1-methyl-2-(methylphenethylamino)ethyl)-alpha-phenyl-, oxalate, hydrate (2:2:1)

Registry Numbers

CAS Registry Number

  • 4383-45-3

System Generated Number

  • 0004383453

Molecular Formulas

Molecular Formula

  • C24-H28-N2-O.C2-H2-O4.1/2H2-O

Molecular Formula Fragments

  • C2-H2-O4
  • C24-H28-N2-O
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C24H28N2O.C2H2O4/c1-20(19-26(2)18-16-21-11-5-3-6-12-21)24(27,22-13-7-4-8-14-22)23-15-9-10-17-25-23;3-1(4)2(5)6/h3-15,17,20,27H,16,18-19H2,1-2H3;(H,3,4)(H,5,6)

InChIKey

AUDOXLAQHZFHHE-UHFFFAOYSA-N

Smiles

c1(ccccn1)[C@@](c1ccccc1)([C@@H](C[N@@](CCc1ccccc1)C)C)O.C(C(=O)O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 oral 500mg/kg (500mg/kg) KIDNEY, URETER, AND BLADDER: URINE VOLUME INCREASED Journal of Medicinal Chemistry. Vol. 8, Pg. 836, 1965.