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CHEBI:70160 - (+)-(S)-dihydro-ar-turmerone

ChEBI IDCHEBI:70160
ChEBI Name(+)-(S)-dihydro-ar-turmerone
Stars
ASCII Name(+)-(S)-dihydro-ar-turmerone
DefinitionA sesquiterpenoid that is 2-methylheptan-4-one substituted by a 4-methylphenyl group at position 6. It has been isolated from Peltophorum dasyrachis.
Last Modified25 March 2015
DownloadsMolfile
FormulaC15H22O
Net Charge0
Average Mass218.340
Monoisotopic Mass218.16707
SMILESCc1ccc([C@@H](C)CC(=O)CC(C)C)cc1
InChIInChI=1S/C15H22O/c1-11(2)9-15(16)10-13(4)14-7-5-12(3)6-8-14/h5-8,11,13H,9-10H2,1-4H3/t13-/m0/s1
InChIKeyFWSUEHMNQCROMJ-ZDUSSCGKSA-N
Species of MetaboliteComponentSourceComments
Peltophorum dasyrachis (IPNI:513013-1) - PubMed (21189039)
Roles Classification
Biological Roles:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
EC 3.1.1.7 (acetylcholinesterase) inhibitor  An EC 3.1.1.* (carboxylic ester hydrolase) inhibitor that interferes with the action of enzyme acetylcholinesterase (EC 3.1.1.7), which helps breaking down of acetylcholine into choline and acetic acid.
ChEBI Ontology
Outgoing Relation(s)
(+)-(S)-dihydro-ar-turmerone (CHEBI:70160) has role EC 3.1.1.7 (acetylcholinesterase) inhibitor (CHEBI:38462)
(+)-(S)-dihydro-ar-turmerone (CHEBI:70160) has role plant metabolite (CHEBI:76924)
(+)-(S)-dihydro-ar-turmerone (CHEBI:70160) is a ketone (CHEBI:17087)
(+)-(S)-dihydro-ar-turmerone (CHEBI:70160) is a sesquiterpenoid (CHEBI:26658)
(+)-(S)-dihydro-ar-turmerone (CHEBI:70160) is a toluenes (CHEBI:27024)
IUPAC Name 
(6S)-2-methyl-6-(4-methylphenyl)heptan-4-one
Registry NumbersSources
Reaxys:2615578Reaxys
Citations