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Substance Name: Benzo(a)pyrene, 4,5-dihydro-4,5-dihydroxy-, (E)-
RN: 37571-88-3
InChIKey: OYOQHRXJXXTZII-WOJBJXKFSA-N

Classification Codes

  • Mutation Data
  • Tumor Data

Molecular Formula

  • C20-H14-O2

Molecular Weight

  • 286.329
 
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Names and Synonyms

Synonyms

  • Benzo(a)pyrene-4,5-dihydrodiol, (E)-
  • trans-4,5-Dihydro-4,5-dihydroxybenzo(a)pyrene
  • trans-4,5-Dihydrobenzo(a)pyrene-4,5-diol
  • trans-4,5-Dihydroxy-4,5-dihydrobenzo(a)pyrene
  • trans-Benzo(a)pyrene-4,5-dihydrodiol

Systematic Name

  • Benzo(a)pyrene, 4,5-dihydro-4,5-dihydroxy-, (E)-

Registry Numbers

CAS Registry Number

  • 37571-88-3

System Generated Number

  • 0037571883

Structure Descriptors

InChI

1S/C20H14O2/c21-19-15-7-3-5-11-8-9-14-13-6-2-1-4-12(13)10-16(20(19)22)18(14)17(11)15/h1-10,19-22H/t19-,20-/m1/s1

InChIKey

OYOQHRXJXXTZII-WOJBJXKFSA-N

Smiles

c12c3c4[C@@H](O)[C@@H](c2cc2c(c1ccc3ccc4)cccc2)O