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Substance Name: 4H-Pyrimido(6,1-a)isoquinolin-4-one, 2,3,6,7-tetrahydro-9,10-dimethoxy-3,6,7-trimethyl-2-((2,4,6-trimethylphenyl)imino)-, monohydrochloride, (6S-trans)-
RN: 108589-79-3
InChIKey: RETYOYLFNORTFP-VEWBGASHSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C26-H31-N3-O3.Cl-H

Molecular Weight

  • 470.0098
 
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Names and Synonyms

  • 4H-Pyrimido(6,1-a)isoquinolin-4-one, 2,3,6,7-tetrahydro-9,10-dimethoxy-3,6,7-trimethyl-2-((2,4,6-trimethylphenyl)imino)-, monohydrochloride, (6S-trans)-

Registry Numbers

CAS Registry Number

  • 108589-79-3

System Generated Number

  • 0108589793

Molecular Formulas

Molecular Formula

  • C26-H31-N3-O3.Cl-H

Molecular Formula Fragments

  • C26-H31-N3-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C26H31N3O3.ClH/c1-14-9-15(2)25(16(3)10-14)27-24-13-21-20-12-23(32-8)22(31-7)11-19(20)17(4)18(5)29(21)26(30)28(24)6;/h9-13,17-18H,1-8H3;1H/b27-24+;/t17-,18-;/m0./s1

InChIKey

RETYOYLFNORTFP-VEWBGASHSA-N

Smiles

Cc1cc(c(c(c1)C)/N=c/2\cc-3n(c(=O)n2C)[C@H]([C@@H](c4c3cc(c(c4)OC)OC)C)C)C.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo oral 80mg/kg (80mg/kg)   Helvetica Chimica Acta. Vol. 69, Pg. 1671, 1986.