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CHEBI:168751 - R-cucujolide V

ChEBI IDCHEBI:168751
ChEBI NameR-cucujolide V
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H22O2
Net Charge0
Average Mass222.328
Monoisotopic Mass222.16198
SMILESC[C@@H]1CCC/C=C\C/C=C\CCCC(=O)O1
InChIInChI=1S/C14H22O2/c1-13-11-9-7-5-3-2-4-6-8-10-12-14(15)16-13/h3-6,13H,2,7-12H2,1H3/b5-3-,6-4-/t13-/m1/s1
InChIKeyJSZKXZJGTWVDOI-LPFHBXDTSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
ChEBI Ontology
Outgoing Relation(s)
R-cucujolide V (CHEBI:168751) is a macrolide (CHEBI:25106)
IUPAC Name 
(6Z,9Z,14R)-14-methyl-1-oxacyclotetradeca-6,9-dien-2-one
Manual XrefsDatabases
62916459ChemSpider
LMFA07040048LIPID MAPS