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Substance Name: Benz(a)anthracene-7,12-dimethanol, 3,4-dihydro-3,4-dihydroxy-, (E)-
RN: 69260-85-1
InChIKey: MSEPVWJAXDXICK-UYAOXDASSA-N

Classification Codes

  • Mutation Data
  • Tumor Data

Molecular Formula

  • C20-H18-O4

Molecular Weight

  • 322.358
 
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Names and Synonyms

Synonyms

  • (E)-3,4-Dihydroxy-3,4-dihydrobenz(a)anthracene-7,12-dimethanol
  • trans-3,4-Dihydroxy-3,4-dihydro-7,12-dihydroxymethylbenz(a)anthracene

Systematic Name

  • Benz(a)anthracene-7,12-dimethanol, 3,4-dihydro-3,4-dihydroxy-, (E)-

Registry Numbers

CAS Registry Number

  • 69260-85-1

System Generated Number

  • 0069260851

Structure Descriptors

InChI

1S/C20H18O4/c21-9-16-11-3-1-2-4-12(11)17(10-22)19-13-7-8-18(23)20(24)15(13)6-5-14(16)19/h1-8,18,20-24H,9-10H2/t18-,20-/m1/s1

InChIKey

MSEPVWJAXDXICK-UYAOXDASSA-N

Smiles

c12c(c(c3ccccc3c2CO)CO)ccc2c1C=C[C@H]([C@@H]2O)O