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Substance Name: Benz(j)aceanthrylene, 1,2-dihydro-4-methyl- (9CI)
RN: 17012-89-4
InChIKey: DYGZCALVTOKEJQ-UHFFFAOYSA-N

Classification Code

  • Tumor Data

Molecular Formula

  • C21-H16

Molecular Weight

  • 268.357
 
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Names and Synonyms

Synonyms

  • 1,2-Dihydro-4-methylbenz(j)aceanthrylene
  • 22-Methylcholanthrene
  • 3-05-00-02487 (Beilstein Handbook Reference)
  • 4-Methylcholanthrene
  • BRN 3316624

Systematic Names

  • Benz(j)aceanthrylene, 1,2-dihydro-4-methyl- (9CI)
  • Cholanthrene, 4-methyl-

Registry Numbers

CAS Registry Number

  • 17012-89-4

System Generated Number

  • 0017012894

Structure Descriptors

InChI

1S/C21H16/c1-13-10-15-7-9-19-18-8-6-14-4-2-3-5-17(14)20(18)12-16(11-13)21(15)19/h2-6,8,10-12H,7,9H2,1H3

InChIKey

DYGZCALVTOKEJQ-UHFFFAOYSA-N

Smiles

C1Cc2cc(cc3cc4c5c(ccc4c1c23)cccc5)C