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CHEBI:33172 - octaphenylene

ChEBI IDCHEBI:33172
ChEBI Nameoctaphenylene
Stars
Last Modified19 November 2006
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC48H32
Net Charge0
Average Mass608.784
Monoisotopic Mass608.25040
SMILESc1ccc2c(c1)-c1ccccc1-c1ccccc1-c1ccccc1-c1ccccc1-c1ccccc1-c1ccccc1-c1ccccc1-2
InChIInChI=1S/C48H32/c1-2-18-34-33(17-1)35-19-3-4-21-37(35)39-23-7-8-25-41(39)43-27-11-12-29-45(43)47-31-15-16-32-48(47)46-30-14-13-28-44(46)42-26-10-9-24-40(42)38-22-6-5-20-36(34)38/h1-32H/b35-33-,36-34-,39-37-,40-38-,43-41-,44-42-,47-45-,48-46-
InChIKeyNOAKQZUXUXSOTC-QYONKELQSA-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)
octaphenylene (CHEBI:33172) is a ortho-fused polycyclic arene (CHEBI:35296)
IUPAC Name 
octaphenylene
Registry NumbersSources
Beilstein:2550013Beilstein