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CHEBI:33159 - pyranthrene

ChEBI IDCHEBI:33159
ChEBI Namepyranthrene
Stars
Last Modified19 November 2006
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC30H16
Net Charge0
Average Mass376.458
Monoisotopic Mass376.12520
SMILESc1ccc2c(c1)cc1ccc3cc4c5ccccc5cc5ccc6cc2c1c3c6c54
InChIInChI=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
InChIKeyLNKHTYQPVMAJSF-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)
pyranthrene (CHEBI:33159) is a ortho- and peri-fused polycyclic arene (CHEBI:35300)
IUPAC Name 
pyranthrene
Registry NumbersSources
Beilstein:1915988Beilstein
CAS:191-13-9ChemIDplus
CAS:191-13-9NIST Chemistry WebBook