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Substance Name: Benzo(a)pyrene, 7,8-dihydro-7,8-dihydroxy-, (+-)-trans-
RN: 61443-57-0
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

  • (+,-)-trans-7,8-Dihydroxy-7,8-dihydrobenzo(a)pyrene
  • (+-)-trans-BP 7,8-dihydrodiol
  • (+/-)-Benzo(a)pyrene-7,8-dihydrodiol
  • (+/-)-trans-7,8-Dihydrobenzo(a)pyrene-7,8-diol
  • (+/-)-trans-7,8-Dihydroxy-7,8-dihyrobenzo(a)pyrene
  • CCRIS 77

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-, (7R,8R)-rel-

Registry Numbers

CAS Registry Number

  • 61443-57-0

System Generated Number

  • 0061443570

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(c3c4c5c(cc3)cccc5ccc4c2)C1)O)O