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Substance Name: Cholanthrene, 11,12-dihydro-3-methyl-
RN: 25486-92-4
InChIKey: RDCLPONBGABOJJ-UHFFFAOYSA-N

Classification Codes

  • Mutation Data
  • Tumor Data

Molecular Formula

  • C21-H18

Molecular Weight

  • 270.373
 
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Names and Synonyms

Synonyms

  • 11,12-Dihydro-3-methylcholanthrene
  • 3-05-00-02429 (Beilstein Handbook Reference)
  • Benz(j)aceanthrylene, 1,2,11,12-tetrahydro-3-methyl-
  • BRN 2133982
  • Cholanthrene, 11,12-dihydro-3-methyl-

Systematic Names

  • Benz(j)aceanthrylene, 1,2,11,12-tetrahydro-3-methyl-
  • Cholanthrene, 11,12-dihydro-3-methyl-

Registry Numbers

CAS Registry Number

  • 25486-92-4

System Generated Number

  • 0025486924

Structure Descriptors

InChI

1S/C21H18/c1-13-6-7-15-12-20-17-5-3-2-4-14(17)8-9-18(20)19-11-10-16(13)21(15)19/h2-7,12H,8-11H2,1H3

InChIKey

RDCLPONBGABOJJ-UHFFFAOYSA-N

Smiles

c1ccc2CCc3c(c2c1)cc1ccc(C)c2c1c3CC2