(E,13S)-13-hydroxyoctadec-11-en-9-ynoic acid (CHEBI:218210)

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CHEBI:218210 - (E,13S)-13-hydroxyoctadec-11-en-9-ynoic acid

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ChEBI ID	CHEBI:218210
ChEBI Name	(E,13S)-13-hydroxyoctadec-11-en-9-ynoic acid
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C18H30O3
Net Charge	0
Average Mass	294.435
Monoisotopic Mass	294.21949
SMILES	CCCCC[C@H](O)/C=C/C#CCCCCCCCC(=O)O
InChI	InChI=1S/C18H30O3/c1-2-3-11-14-17(19)15-12-9-7-5-4-6-8-10-13-16-18(20)21/h12,15,17,19H,2-6,8,10-11,13-14,16H2,1H3,(H,20,21)/b15-12+/t17-/m0/s1
InChIKey	FYPCNVCBWHQKJO-VMEIHUARSA-N

Species of Metabolite	Component	Source	Comments
Pseudanabaenaspecies (ncbitaxon:1153)	-	PubMed (29595272)

Roles Classification

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

ChEBI Ontology

Outgoing Relation(s)
	(E,13S)-13-hydroxyoctadec-11-en-9-ynoic acid (CHEBI:218210) is a long-chain fatty acid (CHEBI:15904)

IUPAC Name
(E,13S)-13-hydroxyoctadec-11-en-9-ynoic acid

Manual Xrefs	Databases
9045413	ChemSpider