CHEBI:51411 - circumbiphenyl

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name circumbiphenyl
ChEBI ID CHEBI:51411
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C38H16
Net Charge 0
Average Mass 472.53364
Monoisotopic Mass 472.12520
InChI InChI=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
InChIKey BEWSIRCXMVBNRU-UHFFFAOYSA-N
SMILES c1cc2ccc3c4ccc5ccc6ccc7ccc8c9ccc%10ccc1c1c2c3c(c9c%101)c1c4c5c6c7c81
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 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]coronene NIST Chemistry WebBook
Registry Numbers Types Sources
2341984 Beilstein Registry Number Beilstein
41163-25-1 CAS Registry Number ChemIDplus
41163-25-1 CAS Registry Number NIST Chemistry WebBook
Last Modified
19 January 2009