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Substance Name: 2H-1-Benzopyran-2-one, 8-((cyclohexyl(2-hydroxy-2-phenylethyl)amino)methyl)-7-hydroxy-4-methyl-, hydrochloride
RN: 57028-63-4
InChIKey: GNRWXMWSYDKSHY-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C25-H29-N-O4.Cl-H

Molecular Weight

  • 443.968
 
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Names and Synonyms

  • 2H-1-Benzopyran-2-one, 8-((cyclohexyl(2-hydroxy-2-phenylethyl)amino)methyl)-7-hydroxy-4-methyl-, hydrochloride

Registry Numbers

CAS Registry Number

  • 57028-63-4

System Generated Number

  • 0057028634

Molecular Formulas

Molecular Formula

  • C25-H29-N-O4.Cl-H

Molecular Formula Fragments

  • C25-H29-N-O4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C25H29NO4.ClH/c1-17-14-24(29)30-25-20(17)12-13-22(27)21(25)15-26(19-10-6-3-7-11-19)16-23(28)18-8-4-2-5-9-18;/h2,4-5,8-9,12-14,19,23,27-28H,3,6-7,10-11,15-16H2,1H3;1H

InChIKey

GNRWXMWSYDKSHY-UHFFFAOYSA-N

Smiles

Cc1cc(=O)oc2c1ccc(c2CN(CC(c3ccccc3)O)C4CCCCC4)O.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intraperitoneal 600mg/kg (600mg/kg)   Research Communications in Chemical Pathology and Pharmacology. Vol. 11, Pg. 651, 1975.