CHEBI:177713 - (4S)-4-[(2E,4Z)-2,4-Decadienoyloxy]-4-(trimethylammonio)butanoate

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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 (4S)-4-[(2E,4Z)-2,4-Decadienoyloxy]-4-(trimethylammonio)butanoate
ChEBI ID CHEBI:177713
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C17H29NO4
Net Charge 0
Average Mass 311.422
Monoisotopic Mass 311.20966
InChI InChI=1S/C17H29NO4/c1-5-6-7-8-9-10-11-12-17(21)22-15(18(2,3)4)13-14-16(19)20/h9-12,15H,5-8,13-14H2,1-4H3/b10-9-,12-11+/t15-/m0/s1
InChIKey GDMITEPIMYKPHX-USKNYQQNSA-N
SMILES O([C@H]([N+](C)(C)C)CCC([O-])=O)C(=O)/C=C/C=C\CCCCC
Metabolite of Species Details
Sus scrofa (NCBI:txid9823) Found in Sausage (ENVO:00002166). See: MetaboLights Study
ChEBI Ontology
Outgoing (4S)-4-[(2E,4Z)-2,4-Decadienoyloxy]-4-(trimethylammonio)butanoate (CHEBI:177713) is a fatty acid ester (CHEBI:35748)
IUPAC Name
(4S)-4-[(2E,4Z)-deca-2,4-dienoyl]oxy-4-(trimethylazaniumyl)butanoate
Manual Xrefs Databases
30776706 ChemSpider
HMDB0013325 HMDB
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