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CHEBI:51411 - circumbiphenyl

ChEBI IDCHEBI:51411
ChEBI Namecircumbiphenyl
Stars
Last Modified19 January 2009
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC38H16
Net Charge0
Average Mass472.546
Monoisotopic Mass472.12520
SMILESc1cc2ccc3c4ccc5ccc6ccc7ccc8c9ccc%10ccc1c1c2c3c(c9c%101)c1c4c5c6c7c81
InChIInChI=1S/C38H16/c1-5-19-9-13-23-25-15-11-21-7-3-18-4-8-22-12-16-26-24-14-10-20-6-2-17(1)27-29(19)33(23)37(34(24)30(20)27)38-35(25)31(21)28(18)32(22)36(26)38/h1-16H
InChIKeyBEWSIRCXMVBNRU-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)
circumbiphenyl (CHEBI:51411) is a ortho- and peri-fused polycyclic arene (CHEBI:35300)
IUPAC Name 
naphtho[7',8',1',2':5,10,4]anthra[1,9,8-abcd]coronene
Synonym  Source
naphth[2',1',8',7':4,10,5]anthra[1,9,8-abcd]coroneneNIST Chemistry WebBook
Registry NumbersSources
Beilstein:2341984Beilstein
CAS:41163-25-1NIST Chemistry WebBook
CAS:41163-25-1ChemIDplus