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CHEBI:197211 - 14,15-EE-5(Z)-E

ChEBI IDCHEBI:197211
ChEBI Name14,15-EE-5(Z)-E
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H36O3
Net Charge0
Average Mass324.505
Monoisotopic Mass324.26645
SMILESCCCCCC1OC1CCCCCCCC=CCCCC(=O)O
InChIInChI=1S/C20H36O3/c1-2-3-12-15-18-19(23-18)16-13-10-8-6-4-5-7-9-11-14-17-20(21)22/h7,9,18-19H,2-6,8,10-17H2,1H3,(H,21,22)
InChIKeyKZTLOTWHEAHQAZ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Cannabis sativa (ncbitaxon:3483) inflorescence (BTO:0000628) MetaboLights (MTBLS6032) Strain: Cannabis sativa var. DMG265
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
14,15-EE-5(Z)-E (CHEBI:197211) is a long-chain fatty acid (CHEBI:15904)
IUPAC Name 
13-(3-pentyloxiran-2-yl)tridec-5-enoic acid
Manual XrefsDatabases
26458442ChemSpider
HMDB0244590HMDB