(5Z,9Z)-2-methoxy-hexacosadienoic acid (CHEBI:187350)

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CHEBI:187350 - (5Z,9Z)-2-methoxy-hexacosadienoic acid

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ChEBI ID	CHEBI:187350
ChEBI Name	(5Z,9Z)-2-methoxy-hexacosadienoic acid
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C27H50O3
Net Charge	0
Average Mass	422.694
Monoisotopic Mass	422.37600
SMILES	CCCCCCCCCCCCCCCC/C=C\CC/C=C\CCC(OC)C(=O)O
InChI	InChI=1S/C27H50O3/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(30-2)27(28)29/h18-19,22-23,26H,3-17,20-21,24-25H2,1-2H3,(H,28,29)/b19-18-,23-22-
InChIKey	USCVSTUZLRXEMP-ZCIBKELESA-N

Species of Metabolite	Component	Source	Comments
Mus musculus (ncbitaxon:10090)	feces (BTO:0000440)	MetaboLights (MTBLS3750)	Strain: C57BL/6 Mouse [NCIT:C14424]

Roles Classification

Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base).

ChEBI Ontology

Outgoing Relation(s)
	(5Z,9Z)-2-methoxy-hexacosadienoic acid (CHEBI:187350) is a very long-chain fatty acid (CHEBI:27283)

IUPAC Name
(5Z,9Z)-2-methoxyhexacosa-5,9-dienoic acid

Manual Xrefs	Databases
10473364	ChemSpider
LMFA01080023	LIPID MAPS