EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:35861 - dibenzo[a,l]pyrene

ChEBI IDCHEBI:35861
ChEBI Namedibenzo[a,l]pyrene
Stars
ASCII Namedibenzo[a,l]pyrene
Last Modified28 July 2014
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC24H14
Net Charge0
Average Mass302.376
Monoisotopic Mass302.10955
SMILESc1ccc2c(c1)cc1ccc3cccc4c5ccccc5c2c1c34
InChIInChI=1S/C24H14/c1-2-8-18-16(6-1)14-17-13-12-15-7-5-11-20-19-9-3-4-10-21(19)24(18)23(17)22(15)20/h1-14H
InChIKeyJNTHRSHGARDABO-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - DOI (10.1038/nbt.2488)
Roles Classification
Biological Roles:
mutagen  An agent that increases the frequency of mutations above the normal background level, usually by interacting directly with DNA and causing it damage, including base substitution.
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
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.
Application:
endocrine disruptor  Any compound that can disrupt the functions of the endocrine (hormone) system
ChEBI Ontology
Outgoing Relation(s)
dibenzo[a,l]pyrene (CHEBI:35861) has role human metabolite (CHEBI:77746)
dibenzo[a,l]pyrene (CHEBI:35861) has role mutagen (CHEBI:25435)
dibenzo[a,l]pyrene (CHEBI:35861) is a ortho- and peri-fused polycyclic arene (CHEBI:35300)
IUPAC Name 
naphtho[1,2,3,4-pqr]tetraphene
Synonyms  Source
1,2,3,4-DibenzpyreneChemIDplus
1,2,9,10-DibenzopyreneChemIDplus
1,2:3,4-DibenzopyreneChemIDplus
2,3:4,5-DibenzopyreneChemIDplus
4,5,6,7-DibenzpyreneChemIDplus
Dibenzo[def,p]chryseneNIST Chemistry WebBook
Manual XrefsDatabases
C19174KEGG COMPOUND
Registry NumbersSources
Beilstein:2054068Beilstein
CAS:191-30-0ChemIDplus
CAS:191-30-0NIST Chemistry WebBook
CAS:191-30-0KEGG COMPOUND