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Substance Name: anti-9-Hydroxychrysene-1,2-diol-3,4-epoxide
RN: 88847-41-0
InChIKey: PAPRUUIWEKWIAZ-XWTMOSNGSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C18-H14-O4

Molecular Weight

  • 294.305
 
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Names and Synonyms

Results Name

  • anti-9-Hydroxychrysene-1,2-diol-3,4-epoxide

Synonyms

  • (Z)-1,2,2a,3a-Tetrahydrochryseno(3,4-b)oxirene-1,2,8-triol
  • 9-Hydroxy-r-1,t-2-dihydroxy-c-3,4-oxy-1,2,3,4-tetrahydrochrysene
  • CCRIS 2035
  • syn-9-Hydroxychrysenediol 3,4-oxide
  • syn-Chrysenetriol epoxide

Systematic Names

  • anti-9-Hydroxychrysene-1,2-diol-3,4-epoxide
  • Chryseno(3,4-b)oxirene-1,2,8-triol, 1,2,2a,3a-tetrahydro-, (1-alpha,2-beta,2a-alpha,3a-alpha)-

Registry Numbers

CAS Registry Number

  • 88847-41-0

System Generated Number

  • 0088847410

Structure Descriptors

InChI

1S/C18H14O4/c19-9-3-1-8-2-4-11-10(13(8)7-9)5-6-12-14(11)17-18(22-17)16(21)15(12)20/h1-7,15-21H/t15-,16+,17-,18+/m0/s1

InChIKey

PAPRUUIWEKWIAZ-XWTMOSNGSA-N

Smiles

c1c2c(ccc3ccc(cc23)O)c2c([C@@H]([C@H]([C@@H]3[C@@H]2O3)O)O)c1