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Substance Name: 4,4',5'-Trimethylazapsoralen
RN: 120482-97-5
InChIKey: PVGCABHUJKHXIP-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H11-N-O3

Molecular Weight

  • 229.234
 
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Names and Synonyms

Name of Substance

  • 4,4',5'-Trimethylazapsoralen

Synonyms

  • 2,3,5-Trimethyl-7H-furo(2,3-b)pyrano(3,2-e)pyridin-7-one
  • 4,4',5'-TMAP
  • 4,4',5'-Trimethylazapsoralen
  • BRN 4872615

Systematic Name

  • 7H-Furo(2,3-b)pyrano(3,2-e)pyridin-7-one, 2,3,5-trimethyl-

Registry Numbers

CAS Registry Number

  • 120482-97-5

System Generated Number

  • 0120482975

Structure Descriptors

InChI

1S/C13H11NO3/c1-6-4-11(15)17-12-9(6)5-10-7(2)8(3)16-13(10)14-12/h4-5H,1-3H3

InChIKey

PVGCABHUJKHXIP-UHFFFAOYSA-N

Smiles

c12c(cc3c(n1)oc(cc3C)=O)c(c(o2)C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 2gm/kg (2000mg/kg)   Farmaco. Vol. 46, Pg. 1407, 1991.