CHEBI:187717 - Type IV cyanolipid 20:2 ester

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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 Type IV cyanolipid 20:2 ester
ChEBI ID CHEBI:187717
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C25H41NO2
Net Charge 0
Average Mass 387.608
Monoisotopic Mass 387.31373
InChI InChI=1S/C25H41NO2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25(27)28-24(22-26)23(2)3/h8-9,11-12,24H,2,4-7,10,13-21H2,1,3H3/b9-8-,12-11-
InChIKey AJPBIUFGQARABL-MURFETPASA-N
SMILES O(C(=O)CCCCCCCCC/C=C\C/C=C\CCCCC)C(C(C)=C)C#N
Metabolite of Species Details
Mus musculus (NCBI:txid10090) Found in feces (BTO:0000440). of strain C57BL/6 Mouse [NCIT:C14424] See: MetaboLights Study
ChEBI Ontology
Outgoing Type IV cyanolipid 20:2 ester (CHEBI:187717) is a fatty acid ester (CHEBI:35748)
Type IV cyanolipid 20:2 ester (CHEBI:187717) is a nitrile (CHEBI:18379)
IUPAC Name
(1-cyano-2-methylprop-2-enyl) (11Z,14Z)-icosa-11,14-dienoate
Manual Xrefs Databases
113368630 ChemSpider
LMFA07030011 LIPID MAPS
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