CHEBI:33159 - pyranthrene

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name pyranthrene
ChEBI ID CHEBI:33159
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C30H16
Net Charge 0
Average Mass 376.44804
Monoisotopic Mass 376.12520
InChI InChI=1S/C30H16/c1-3-7-23-17(5-1)13-19-9-11-22-16-26-24-8-4-2-6-18(24)14-20-10-12-21-15-25(23)27(19)29(22)30(21)28(20)26/h1-16H
InChIKey LNKHTYQPVMAJSF-UHFFFAOYSA-N
SMILES c1ccc2c(c1)cc1ccc3cc4c5ccccc5cc5ccc6cc2c1c3c6c45
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 pyranthrene (CHEBI:33159) is a ortho- and peri-fused polycyclic arene (CHEBI:35300)
IUPAC Name
pyranthrene
Registry Numbers Types Sources
191-13-9 CAS Registry Number NIST Chemistry WebBook
191-13-9 CAS Registry Number ChemIDplus
1915988 Beilstein Registry Number Beilstein
Last Modified
19 November 2006