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CHEBI:33091 - ovalene

Default Structure
ChEBI IDCHEBI:33091
ChEBI Nameovalene
Stars
Last Modified15 September 2006
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC32H14
Net Charge0
Average Mass398.464
Monoisotopic Mass398.10955
SMILESc1cc2ccc3cc4ccc5ccc6ccc7cc8ccc1c1c2c3c2c4c5c6c7c2c81
InChIInChI=1S/C32H14/c1-2-16-6-10-20-14-22-12-8-18-4-3-17-7-11-21-13-19-9-5-15(1)23-24(16)28(20)32-30(22)26(18)25(17)29(21)31(32)27(19)23/h1-14H
InChIKeyLSQODMMMSXHVCN-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)
ovalene (CHEBI:33091) is a ortho- and peri-fused polycyclic arene (CHEBI:35300)
IUPAC Name 
ovalene
Registry NumbersSources
Gmelin:1621193Gmelin
Beilstein:1893486Beilstein
CAS:190-26-1ChemIDplus
CAS:190-26-1NIST Chemistry WebBook