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Substance Name: 1H-Indole-1-acetic acid, 3-(phenyl(3,4,5-trimethoxyphenyl)methyl)-
RN: 53924-22-4
InChIKey: JOHJZEAIAWYLRX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C26-H25-N-O5

Molecular Weight

  • 431.486
 
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Names and Synonyms

Synonyms

  • 3-(Phenyl(3,4,5-trimethoxyphenyl)methyl)-1H-indole-1-acetic acid
  • BRN 0459455

Systematic Name

  • 1H-Indole-1-acetic acid, 3-(phenyl(3,4,5-trimethoxyphenyl)methyl)-

Registry Numbers

CAS Registry Number

  • 53924-22-4

System Generated Number

  • 0053924224

Structure Descriptors

InChI

1S/C26H25NO5/c1-30-22-13-18(14-23(31-2)26(22)32-3)25(17-9-5-4-6-10-17)20-15-27(16-24(28)29)21-12-8-7-11-19(20)21/h4-15,25H,16H2,1-3H3,(H,28,29)

InChIKey

JOHJZEAIAWYLRX-UHFFFAOYSA-N

Smiles

c1([C@@H](c2cc(c(OC)c(c2)OC)OC)c2ccccc2)c2c(cccc2)n(c1)CC(O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo intraperitoneal 100mg/kg (100mg/kg)   Journal of Medicinal Chemistry. Vol. 17, Pg. 1298, 1974.