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CHEBI:81635 - Benzo[a]pyrene-cis-11,12-dihydrodiol

ChEBI IDCHEBI:81635
ChEBI NameBenzo[a]pyrene-cis-11,12-dihydrodiol
Stars
DownloadsMolfile
FormulaC20H14O2
Net Charge0
Average Mass286.330
Monoisotopic Mass286.09938
SMILESO[C@@H]1c2cccc3ccc4cc5ccccc5c(c4c23)[C@@H]1O
InChIInChI=1S/C20H14O2/c21-19-15-7-3-5-11-8-9-13-10-12-4-1-2-6-14(12)18(20(19)22)17(13)16(11)15/h1-10,19-22H/t19-,20+/m1/s1
InChIKeySGHZUKBSLLOHPU-UXHICEINSA-N
Roles Classification
Biological Role:
xenobiotic  A xenobiotic (Greek, xenos "foreign"; bios "life") is a compound that is foreign to a living organism. Principal xenobiotics include: drugs, carcinogens and various compounds that have been introduced into the environment by artificial means.
ChEBI Ontology
Outgoing Relation(s)
Benzo[a]pyrene-cis-11,12-dihydrodiol (CHEBI:81635) is a phenanthrol (CHEBI:25962)
Manual XrefsDatabases
C18284KEGG COMPOUND
Registry NumbersSources
CAS:64283-13-2KEGG COMPOUND