syn-BP-diolepoxide

Molecular Formula: C20H14O3


InChI: InChI=1/C20H14O3/c21-17-13-8-11-5-4-9-2-1-3-10-6-7-12(15(11)14(9)10)16(13)19-20(23-19)18(17)22/h1-8,17-22H/t17-,18+,19-,20+/m0/s1

InChIKey: InChIKey=DQEPMTIXHXSFOR-ZGXWSNOMBL
SMILES: C1=CC2=C3C(=C1)C=CC4=C3C(=CC5=C4C6C(O6)C(C5O)O)C=C2

Names:
    BPDE II
    BPDE-syn
    BRN 4237437
    B(a)P epoxide I
    CCRIS 796
    syn-Benzo(a)pyrene-diolepoxide
    syn-Benzo(a)pyrene-7,8-diol-9,10-oxide
    syn-BP-diolepoxide
    (+/-)-syn-BPDE
    5-17-05-00496 (Beilstein Handbook Reference)

Registries:
    PubChem CID 42879
    PubChem ID 183359