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CHEBI:84273 - (2,3-diphenylcyclopropyl)methyl phenyl sulfoxide

ChEBI IDCHEBI:84273
ChEBI Name(2,3-diphenylcyclopropyl)methyl phenyl sulfoxide
Stars
DefinitionA sulfoxide in which the S atom is substituted by a phenyl and (2,3-diphenylcyclopropyl)methyl group. Metabolite observed in cancer metabolism.
Last Modified14 January 2015
Submitternamrata
DownloadsMolfile
FormulaC22H20OS
Net Charge0
Average Mass332.468
Monoisotopic Mass332.12349
SMILESO=S(CC1C(c2ccccc2)C1c1ccccc1)c1ccccc1
InChIInChI=1S/C22H20OS/c23-24(19-14-8-3-9-15-19)16-20-21(17-10-4-1-5-11-17)22(20)18-12-6-2-7-13-18/h1-15,20-22H,16H2
InChIKeyMVULGCSHGFLUBH-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
- PubMed (25518943) Metabolite observed in cancer metabolism.
- MetaboLights (MTBLS150)
Roles Classification
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
(2,3-diphenylcyclopropyl)methyl phenyl sulfoxide (CHEBI:84273) has role human metabolite (CHEBI:77746)
(2,3-diphenylcyclopropyl)methyl phenyl sulfoxide (CHEBI:84273) is a benzenes (CHEBI:22712)
(2,3-diphenylcyclopropyl)methyl phenyl sulfoxide (CHEBI:84273) is a cyclopropanes (CHEBI:51454)
(2,3-diphenylcyclopropyl)methyl phenyl sulfoxide (CHEBI:84273) is a sulfoxide (CHEBI:22063)
IUPAC Name 
(2,3-diphenylcyclopropyl)methyl phenyl sulfoxide
Synonym  Source
1,1'-{3-[(phenylsulfinyl)methyl]cyclopropane-1,2-diyl}dibenzeneIUPAC
Registry NumbersSources
Reaxys:4259382Reaxys
Citations