CHEBI:186698 - 13E,15E,18Z,20Z-pentacosatetraen-11-ynyl acetate

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ChEBI Name 13E,15E,18Z,20Z-pentacosatetraen-11-ynyl acetate
ChEBI ID CHEBI:186698
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C27H42O2
Net Charge 0
Average Mass 398.631
Monoisotopic Mass 398.31848
InChI InChI=1S/C27H42O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-29-27(2)28/h6-9,11-14H,3-5,10,17-26H2,1-2H3/b7-6-,9-8-,12-11+,14-13+
InChIKey LWTBVVYDHCHHOE-HYPSEFPRSA-N
SMILES O(CCCCCCCCCCC#C/C=C/C=C/C\C=C/C=C\CCCC)C(=O)C
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 13E,15E,18Z,20Z-pentacosatetraen-11-ynyl acetate (CHEBI:186698) is a carboxylic ester (CHEBI:33308)
IUPAC Name
[(13E,15E,18Z,20Z)-pentacosa-13,15,18,20-tetraen-11-ynyl] acetate
Manual Xrefs Databases
24841969 ChemSpider
LMFA07010407 LIPID MAPS
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