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Substance Name: Isoquinoline, 1,2,3,4-tetrahydro-6,7-dimethoxy-3-(2-ethenyl-4,5-dimethoxyphenyl)-2-methyl-, hydrochloride, (+-)-
RN: 120021-27-4
InChIKey: JTALBLAEUHDTAC-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H27-N-O4.Cl-H

Molecular Weight

  • 405.9192
 
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Names and Synonyms

Synonym

  • 3-(2-Vinyl-4,5-dimethoxyphenyl)-2-methyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline

Systematic Name

  • Isoquinoline, 1,2,3,4-tetrahydro-6,7-dimethoxy-3-(2-ethenyl-4,5-dimethoxyphenyl)-2-methyl-, hydrochloride, (+-)-

Registry Numbers

CAS Registry Number

  • 120021-27-4

System Generated Number

  • 0120021274

Molecular Formulas

Molecular Formula

  • C22-H27-N-O4.Cl-H

Molecular Formula Fragments

  • C22-H27-N-O4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C22H27NO4.ClH/c1-7-14-9-19(24-3)22(27-6)12-17(14)18-8-15-10-20(25-4)21(26-5)11-16(15)13-23(18)2;/h7,9-12,18H,1,8,13H2,2-6H3;1H

InChIKey

JTALBLAEUHDTAC-UHFFFAOYSA-N

Smiles

CN1Cc2cc(c(cc2CC1c3cc(c(cc3C=C)OC)OC)OC)OC.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 200mg/kg (200mg/kg)   Pharmaceutical Chemistry Journal Vol. 23, Pg. 47, 1989.