(6S,13R)-6,13-dihydroxy-2E,4E,8E-tetradecatrienoic acid (CHEBI:206219)

EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:206219 - (6S,13R)-6,13-dihydroxy-2E,4E,8E-tetradecatrienoic acid

Take structure to advanced search

ChEBI ID	CHEBI:206219
ChEBI Name	(6S,13R)-6,13-dihydroxy-2E,4E,8E-tetradecatrienoic acid
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C14H22O4
Net Charge	0
Average Mass	254.326
Monoisotopic Mass	254.15181
SMILES	C[C@@H](O)CCC/C=C/C[C@H](O)/C=C/C=C/C(=O)O
InChI	InChI=1S/C14H22O4/c1-12(15)8-4-2-3-5-9-13(16)10-6-7-11-14(17)18/h3,5-7,10-13,15-16H,2,4,8-9H2,1H3,(H,17,18)/b5-3+,10-6+,11-7+/t12-,13+/m1/s1
InChIKey	OEZQQSZLPKFDKK-RBDWYWNSSA-N

Species of Metabolite	Component	Source	Comments
Mycosphaerella rubella (ncbitaxon:179339)	-	PubMed (9654778)

Roles Classification

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

ChEBI Ontology

Outgoing Relation(s)
	(6S,13R)-6,13-dihydroxy-2E,4E,8E-tetradecatrienoic acid (CHEBI:206219) is a long-chain fatty acid (CHEBI:15904)

IUPAC Name
(2E,4E,6S,8E,13R)-6,13-dihydroxytetradeca-2,4,8-trienoic acid

Manual Xrefs	Databases
8553055	ChemSpider