Benzo[a]pyrene-7,8-dione

ChEBI: An o-quinone resulting from the formal oxidation of both of the hydroxy groups of benzo[a]pyrene-cis-7,8-dihydrodiol. Benzo[a]pyrene-7,8-dione is a metabolite of the widespread carcinogen benzo[ ]pyrene.

Benzo[a]pyrene-7,8-dione is an o-quinone resulting from the formal oxidation of both of the hydroxy groups of benzo[a]pyrene-cis-7,8-dihydrodiol. Benzo[a]pyrene-7,8-dione is a metabolite of the widespread carcinogen benzo[a]pyrene. It has a role as a xenobiotic metabolite and a genotoxin. It is a member of pyrenes and a member of orthoquinones. It derives from a benzo[a]pyrene-cis-7,8-dihydrodiol. It derives from a hydride of a benzo[a]pyrene.

Molecular Weight:282.3
XLogP3:4.6
Hydrogen Bond Acceptor Count:2
Exact Mass:282.068079557
Monoisotopic Mass:282.068079557
Topological Polar Surface Area:34.1
Heavy Atom Count:22
Complexity:548
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes