CHEBI:82442 - Dibenzo[a,e]pyrene

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Dibenzo[a,e]pyrene
ChEBI ID CHEBI:82442
Stars This entity has been manually annotated by a third party.
Supplier Information ChemicalBook:CB1255146, eMolecules:535566, ZINC000002168416
Download Molfile XML SDF
Formula C24H14
Net Charge 0
Average Mass 302.36800
Monoisotopic Mass 302.10955
InChI InChI=1S/C24H14/c1-2-8-17-16(6-1)14-22-19-10-4-3-9-18(19)20-11-5-7-15-12-13-21(17)24(22)23(15)20/h1-14H
InChIKey KGHMWBNEMFNJFZ-UHFFFAOYSA-N
SMILES c1ccc2c(c1)cc1c3ccccc3c3cccc4ccc2c1c34
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 Dibenzo[a,e]pyrene (CHEBI:82442) is a ortho- and peri-fused polycyclic arene (CHEBI:35300)
Synonym Source
Naphtho[1,2,3,4-def]chrysene KEGG COMPOUND
Manual Xref Database
C19393 KEGG COMPOUND
View more database links
Registry Number Type Source
192-65-4 CAS Registry Number KEGG COMPOUND