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Substance Name: 5H-1,3-Dioxolo(4,5-f)indole-7-acetic acid, 6-methyl-5-(1-oxo-3-phenyl-2-propenyl)-
RN: 37646-31-4
InChIKey: BAOWVODWXXCRBH-FPLPWBNLSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H17-N-O5

Molecular Weight

  • 363.3673
 
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Names and Synonyms

Synonyms

  • 1-Cinnamoyl-2-methyl-5,6-methylenedioxy-3-indolylacetic acid
  • 6-Methyl-5-(1-oxo-3-phenyl-2-propenyl)-5H-1,3-dioxolo(4,5-f)indole-7-acetic acid
  • BRN 1043833
  • ID-1619

Systematic Name

  • 5H-1,3-Dioxolo(4,5-f)indole-7-acetic acid, 6-methyl-5-(1-oxo-3-phenyl-2-propenyl)-

Registry Numbers

CAS Registry Number

  • 37646-31-4

System Generated Number

  • 0037646314

Structure Descriptors

InChI

1S/C21H17NO5/c1-13-15(10-21(24)25)16-9-18-19(27-12-26-18)11-17(16)22(13)20(23)8-7-14-5-3-2-4-6-14/h2-9,11H,10,12H2,1H3,(H,24,25)/b8-7-

InChIKey

BAOWVODWXXCRBH-FPLPWBNLSA-N

Smiles

Cc1c(c2cc3c(cc2n1C(=O)/C=C\c4ccccc4)OCO3)CC(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1gm/kg (1000mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 22, Pg. 2099, 1972.
mouse LD50 oral 1450mg/kg (1450mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 22, Pg. 2099, 1972.
rat LDLo oral 2gm/kg (2000mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 22, Pg. 2099, 1972.