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Substance Name: 11,12-Dihydroxy-13,14-epoxy-11,12,13,14-tetrahydrodibenzo(a,l)pyrene
RN: 153857-28-4
InChIKey: CJAMAUFDXDSQLU-NAVOZUGXSA-N

Molecular Formula

  • C24-H16-O3

Molecular Weight

  • 352.3874
 
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Names and Synonyms

Name of Substance

  • 11,12-Dihydroxy-13,14-epoxy-11,12,13,14-tetrahydrodibenzo(a,l)pyrene

Synonyms

  • 11,12,12a,13a-Tetrahydro- (11alpha,12abeta,13abeta)dibenzo(5,6:10,11)chryseno(3,4-b)oxirene-11,12-diol
  • CCRIS 7385
  • syn-11,12,12a,13a-Tetrahydrodibenzo(5,6:10,11)chryseno(3,4-b)oxirene-11,12-diol
  • syn-Dibenzo(a,l)pyrene diolepoxide

Systematic Names

  • Dibenzo(5,6:10,11)chryseno(3,4-b)oxirene-11,12-diol, 11,12,12a,13a-tetrahydro- (11alpha,12abeta,13abeta)-
  • Dibenzo(5,6:10,11)chryseno(3,4-b)oxirene-11,12-diol, 11,12,12a,13a-tetrahydro-, (11R,12S,12aR,13aS)-rel-
  • syn-Dibenzo(a,l)pyrene-11,12-dihydrodiol-13,14-epoxide

Registry Numbers

CAS Registry Number

  • 153857-28-4

System Generated Number

  • 0153857284

Structure Descriptors

InChI

1S/C24H16O3/c25-21-16-10-12-9-8-11-4-3-7-14-13-5-1-2-6-15(13)19(18(12)17(11)14)20(16)23-24(27-23)22(21)26/h1-10,21-26H/t21-,22+,23+,24-/m1/s1

InChIKey

CJAMAUFDXDSQLU-NAVOZUGXSA-N

Smiles

c1ccc2c(c1)c3cccc4c3c5c2c6c(cc5cc4)[C@H]([C@@H]([C@@H]7[C@H]6O7)O)O