9-methoxy-heptadecanoic acid (CHEBI:190113)

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CHEBI:190113 - 9-methoxy-heptadecanoic acid

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ChEBI ID	CHEBI:190113
ChEBI Name	9-methoxy-heptadecanoic acid
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C18H36O3
Net Charge	0
Average Mass	300.483
Monoisotopic Mass	300.26645
SMILES	CCCCCCCCC(CCCCCCCC(=O)O)OC
InChI	InChI=1S/C18H36O3/c1-3-4-5-6-8-11-14-17(21-2)15-12-9-7-10-13-16-18(19)20/h17H,3-16H2,1-2H3,(H,19,20)
InChIKey	OJVARKQKLHOOKH-UHFFFAOYSA-N

Species of Metabolite	Component	Source	Comments
Brassica napus (ncbitaxon:3708)	flower (BTO:0000469)	MetaboLights (MTBLS3950)

Roles Classification

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

ChEBI Ontology

Outgoing Relation(s)
	9-methoxy-heptadecanoic acid (CHEBI:190113) is a long-chain fatty acid (CHEBI:15904)

IUPAC Name
9-methoxyheptadecanoic acid

Manual Xrefs	Databases
113368320	ChemSpider
LMFA01080014	LIPID MAPS