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4,5-Dihydroxybenzo[a]pyrene

MNXM163760 is deprecated and replaced by MNXM10149
PropertiesImageOccurences in reactions
MNX_IDMNXM10149Image of MNXM10149
#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 3
formulaC20H12O2
charge0
mass284.08373
referencechebi:81630
InChIKeyAFDHSXYOTGMEAP-UHFFFAOYSA-N
InChIInChI=1S/C20H12O2/c21-19-15-7-3-5-11-8-9-14-13-6-2-1-4-12(13)10-16(20(19)22)18(14)17(11)15/h1-10,21-22H
SMILESOc1c(O)c2cc3ccccc3c3ccc4cccc1c4c23
Parent-child relations graph
 Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
seed.compound:cpd19545
seedM:cpd19545
CHEBI:81630
chebi:81630
kegg.compound:C18279
keggC:C18279 		4,5-Dihydroxybenzo[a]pyrene
Benzo[a]pyrene-4,5-diol
envipath:...e1531c8d48a2
envipathM:...e1531c8d48a2 		4,5-Dihydroxybenzo(a)pyrene
bigg.metabolite:CN0010
biggM:CN0010 		Benzo[a]pyrene-4,5-diol
envipath:...ebb082957d57
envipathM:...ebb082957d57 		compound 0044875
biggM:M_CN0010
keggC:M_C18279
seedM:M_cpd19545 		secondary/obsolete/fantasy identifier