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CHEBI:82503 - 6-Nitrobenzo[a]pyrene

ChEBI IDCHEBI:82503
ChEBI Name6-Nitrobenzo[a]pyrene
Stars
DownloadsMolfile
FormulaC20H11NO2
Net Charge0
Average Mass297.313
Monoisotopic Mass297.07898
SMILESO=[N+]([O-])c1c2ccccc2c2ccc3cccc4ccc1c2c43
InChIInChI=1S/C20H11NO2/c22-21(23)20-16-7-2-1-6-14(16)15-10-8-12-4-3-5-13-9-11-17(20)19(15)18(12)13/h1-11H
InChIKeyNMMAFYSZGOFZCM-UHFFFAOYSA-N
Roles Classification
Biological Role:
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)
6-Nitrobenzo[a]pyrene (CHEBI:82503) is a ortho- and peri-fused polycyclic arene (CHEBI:35300)
Manual XrefsDatabases
C19472KEGG COMPOUND
Registry NumbersSources
CAS:63041-90-7KEGG COMPOUND