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Substance Name: Cinnamic acid, p-methoxy-alpha-(p-methoxyphenyl)-, 3-tropanyl ester, hydrochloride
RN: 67210-56-4
InChIKey: WBFVVFZUPGGLOV-SXMBIPSUSA-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

Synonym

  • p-Methoxy-alpha-(p-methoxyphenyl)cinnamic acid 3-tropanyl ester hydrochloride

Systematic Name

  • Cinnamic acid, p-methoxy-alpha-(p-methoxyphenyl)-, 3-tropanyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 67210-56-4

System Generated Number

  • 0067210564

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/c1-26-19-8-9-20(26)16-23(15-19)30-25(27)24(18-6-12-22(29-3)13-7-18)14-17-4-10-21(28-2)11-5-17;/h4-7,10-14,19-20,23H,8-9,15-16H2,1-3H3;1H/b24-14+;

InChIKey

WBFVVFZUPGGLOV-SXMBIPSUSA-N

Smiles

C(\c1ccc(OC)cc1)(=C/c1ccc(OC)cc1)C(OC1C[C@@H]2[NH+](C)[C@@H](C1)CC2)=O.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo oral 16mg/kg (16mg/kg)   Journal of Medicinal Chemistry. Vol. 13, Pg. 1076, 1970.