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Substance Name: 11-Cholanthrenemethanol
RN: 100895-53-2
InChIKey: PXXZOBYFRLAOIY-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C21-H16-O

Molecular Weight

  • 284.3564
 
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Names and Synonyms

Synonyms

  • 11-Hydroxymethylcholanthrene
  • Benz(j)aceanthrylene-11-methanol, 1,2-dihydro-

Systematic Names

  • 11-Cholanthrenemethanol
  • Benz(j)aceanthrylene-11-methanol, 1,2-dihydro-

Registry Numbers

CAS Registry Number

  • 100895-53-2

System Generated Number

  • 0100895532

Structure Descriptors

InChI

1S/C21H16O/c22-12-15-11-20-18-9-8-13-4-3-5-14(21(13)18)10-19(20)17-7-2-1-6-16(15)17/h1-7,10-11,22H,8-9,12H2

InChIKey

PXXZOBYFRLAOIY-UHFFFAOYSA-N

Smiles

c1ccc2c(c1)c(cc3c2cc4cccc5c4c3CC5)CO