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Substance Name: Benzo(a)pyrene, 7,8-dihydro-7,8-dihydroxy-, (+)-trans-
RN: 62314-67-4
InChIKey: YDXRLMMGARHIIC-PXNSSMCTSA-N

Classification Codes

  • Mutation Data
  • Tumor Data

Molecular Formula

  • C20-H14-O2

Molecular Weight

  • 286.329
 
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Names and Synonyms

Synonyms

  • (+)-7S,8S-Dihydroxy-7,8-dihydrobenzo(a)pyrene
  • (+)-Benzo(a)pyrene-7,8-dihydrodiol
  • (+)-Benzo(a)pyrene-7S,8S-dihydrodiol
  • (+)-trans-7,8-Dihydrobenzo(a)pyrene-7,8-diol
  • (+)-trans-7,8-Dihydroxy-7,8-dihydrobenzo(a)pyrene
  • CCRIS 792

Systematic Names

  • (+)-trans-7,8-Dihydrobenzo(a)pyrene-7,8-diol
  • Benzo(a)pyrene, 7,8-dihydro-7,8-dihydroxy-, (+)-trans-
  • Benzo(a)pyrene-7,8-diol, 7,8-dihydro-, (7S,8S)-

Registry Numbers

CAS Registry Number

  • 62314-67-4

System Generated Number

  • 0062314674

Structure Descriptors

InChI

1S/C20H14O2/c21-17-9-8-14-15-7-6-12-3-1-2-11-4-5-13(19(15)18(11)12)10-16(14)20(17)22/h1-10,17,20-22H/t17-,20-/m0/s1

InChIKey

YDXRLMMGARHIIC-PXNSSMCTSA-N

Smiles

C=1[C@@H]([C@H](c2c(c3ccc4c5c3c(ccc5ccc4)c2)C1)O)O