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Substance Name: Cinnamic acid, alpha-(p-acetoxyphenyl)-, 3-tropanyl ester, hydrochloride
RN: 67210-46-2
InChIKey: ZALZVDBDKIZBQQ-SXMBIPSUSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C25-H27-N-O4.Cl-H

Molecular Weight

  • 441.952
 
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Names and Synonyms

Synonym

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

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 67210-46-2

System Generated Number

  • 0067210462

Molecular Formulas

Molecular Formula

  • C25-H27-N-O4.Cl-H

Molecular Formula Fragments

  • C25-H27-N-O4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C25H27NO4.ClH/c1-17(27)29-22-12-8-19(9-13-22)24(14-18-6-4-3-5-7-18)25(28)30-23-15-20-10-11-21(16-23)26(20)2;/h3-9,12-14,20-21,23H,10-11,15-16H2,1-2H3;1H/b24-14+;

InChIKey

ZALZVDBDKIZBQQ-SXMBIPSUSA-N

Smiles

C(\c1ccc(OC(C)=O)cc1)(=C/c1ccccc1)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 917mg/kg (917mg/kg)   Journal of Medicinal Chemistry. Vol. 13, Pg. 1076, 1970.