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Substance Name: Benz(a)anthracene, 1,2,3,4-tetrahydro-3,4-dihydroxy-1,2-epoxy-, (E)-(+)-
RN: 63438-26-6
InChIKey: JNQSJMYLVFOQBK-XWTMOSNGSA-N

Classification Code

  • Tumor Data

Molecular Formula

  • C18-H10-O3

Molecular Weight

  • 278.3056
 
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Names and Synonyms

Synonyms

  • (+)-trans-3,4-Dihydroxy-1,2-epoxy-1,2,3,4-tetrahydrobenz(a)anthracene
  • (+)-trans-3,4-Dihydroxy-1,2-epoxy-1,2,3,4-tetrahydrobenzo(a)anthracene
  • anti-(+-)-Benz(a)anthracene-trans-3,4-dihydrodiol-1,2-epoxide
  • Benz(a)anthracene, 3,4-dihydroxy-1,2-epoxy-1,2,3,4-tetrahydro-, (E)-, (+)-

Systematic Name

  • Benz(a)anthracene, 1,2,3,4-tetrahydro-3,4-dihydroxy-1,2-epoxy-, (E)-(+)-

Registry Numbers

CAS Registry Number

  • 63438-26-6

System Generated Number

  • 0063438266

Structure Descriptors

InChI

1S/C18H14O3/c19-15-12-6-5-11-7-9-3-1-2-4-10(9)8-13(11)14(12)17-18(21-17)16(15)20/h1-8,15-20H/t15-,16+,17-,18+/m0/s1

InChIKey

JNQSJMYLVFOQBK-XWTMOSNGSA-N

Smiles

c1ccc2cc3c(ccc4c3[C@H]5[C@H](O5)[C@@H]([C@H]4O)O)cc2c1