CHEBI:215505 - (2E,4E,6S,8E,13R)-13-acetyloxy-6-hydroxytetradeca-2,4,8-trienoic acid

ChEBI IDCHEBI:215505
ChEBI Name(2E,4E,6S,8E,13R)-13-acetyloxy-6-hydroxytetradeca-2,4,8-trienoic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H24O5
Net Charge0
Average Mass296.363
Monoisotopic Mass296.16237
SMILESCC(=O)O[C@H](C)CCC/C=C/C[C@H](O)/C=C/C=C/C(=O)O
InChIInChI=1S/C16H24O5/c1-13(21-14(2)17)9-5-3-4-6-10-15(18)11-7-8-12-16(19)20/h4,6-8,11-13,15,18H,3,5,9-10H2,1-2H3,(H,19,20)/b6-4+,11-7+,12-8+/t13-,15+/m1/s1
InChIKeyCFFRJDASPYBVKV-XMUXOCQBSA-N
Species of MetaboliteComponentSourceComments
Mycosphaerella rubella (ncbitaxon:179339) - PubMed (9654778)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
(2E,4E,6S,8E,13R)-13-acetyloxy-6-hydroxytetradeca-2,4,8-trienoic acid (CHEBI:215505) is a long-chain fatty acid (CHEBI:15904)
IUPAC Name 
(2E,4E,6S,8E,13R)-13-acetyloxy-6-hydroxytetradeca-2,4,8-trienoic acid
Manual XrefsDatabases
26669205ChemSpider