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Substance Name: Aristololactam
RN: 13395-02-3
InChIKey: MXOKGWUJNGEKBH-UHFFFAOYSA-N

Note

  • Metabolite of aristolochic acid; forms DNA adducts.

Classification Code

  • Mutation Data

Molecular Formula

  • C17-H11-N-O4

Molecular Weight

  • 293.277
 
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Names and Synonyms

Results Name

  • Aristololactam

Name of Substance

  • Aristolactam I

Synonyms

  • 4-27-00-06628 (Beilstein Handbook Reference)
  • Aristolactam I
  • Aristololactam
  • BRN 0307971
  • CCRIS 1545
  • NSC 87406

Systematic Names

  • Aristololactum
  • Benzo(f)-1,3-benzodioxolo(6,5,4-cd)indol-5(6H)-one, 8-methoxy-

Registry Numbers

CAS Registry Number

  • 13395-02-3

System Generated Number

  • 0013395023

Structure Descriptors

InChI

1S/C17H11NO4/c1-20-12-4-2-3-8-9(12)5-11-14-10(17(19)18-11)6-13-16(15(8)14)22-7-21-13/h2-6H,7H2,1H3,(H,18,19)

InChIKey

MXOKGWUJNGEKBH-UHFFFAOYSA-N

Smiles

c12c3c(c4cccc(c4cc3NC1=O)OC)c1c(c2)OCO1