CHEBI:34337 - 3-Hydroxybenzo[a]pyrene

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 3-Hydroxybenzo[a]pyrene
ChEBI ID CHEBI:34337
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C20H12O
Net Charge 0
Average Mass 268.309
Monoisotopic Mass 268.08882
InChI InChI=1S/C20H12O/c21-18-10-7-12-5-8-16-15-4-2-1-3-13(15)11-14-6-9-17(18)19(12)20(14)16/h1-11,21H
InChIKey SPUUWWRWIAEPDB-UHFFFAOYSA-N
SMILES Oc1ccc2ccc3c4ccccc4cc4ccc1c2c34
Roles Classification
Biological Role(s): carcinogenic agent
A role played by a chemical compound which is known to induce a process of carcinogenesis by corrupting normal cellular pathways, leading to the acquistion of tumoral capabilities.
(via polycyclic arene )
Application(s): endocrine disruptor
Any compound that can disrupt the functions of the endocrine (hormone) system
(via polycyclic arene )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 3-Hydroxybenzo[a]pyrene (CHEBI:34337) is a ortho- and peri-fused polycyclic arene (CHEBI:35300)
Synonym Source
3-Hydroxybenzo[a]pyrene KEGG COMPOUND
Manual Xref Database
C14461 KEGG COMPOUND
View more database links
Registry Number Type Source
13345-21-6 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014