CHEBI:169623 - (2E,8Z)-Decadiene-4,6-diyn-1-yl 3-methylbutanoate

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name (2E,8Z)-Decadiene-4,6-diyn-1-yl 3-methylbutanoate
ChEBI ID CHEBI:169623
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C15H18O2
Net Charge 0
Average Mass 230.307
Monoisotopic Mass 230.13068
InChI InChI=1S/C15H18O2/c1-4-5-6-7-8-9-10-11-12-17-15(16)13-14(2)3/h4-5,10-11,14H,12-13H2,1-3H3/b5-4-,11-10+
InChIKey FPIBENZMUTVCEK-JWPKELMXSA-N
SMILES O(C(=O)CC(C)C)C/C=C/C#CC#C/C=C\C
Metabolite of Species Details
Malus domestica (NCBI:txid3750) Found in exocarp (BTO:0000733). of strain Malus x domestica Borkh. cv. Ruixue See: MetaboLights Study
ChEBI Ontology
Outgoing (2E,8Z)-Decadiene-4,6-diyn-1-yl 3-methylbutanoate (CHEBI:169623) is a carboxylic ester (CHEBI:33308)
IUPAC Name
[(2E,8Z)-deca-2,8-dien-4,6-diynyl] 3-methylbutanoate
Manual Xrefs Databases
4509558 ChemSpider
HMDB0035425 HMDB
LMFA07010699 LIPID MAPS
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