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CHEBI:176394 - Dihydroxy-octadecatrienoate

ChEBI IDCHEBI:176394
ChEBI NameDihydroxy-octadecatrienoate
Stars
Last Modified24 February 2022
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H30O4
Net Charge0
Average Mass310.434
Monoisotopic Mass310.21441
SMILESCCCCC/C=C\[C@@H](O)[C@H](O)/C=C\C=C\CCCCC(=O)O
InChIInChI=1S/C18H30O4/c1-2-3-4-7-10-13-16(19)17(20)14-11-8-5-6-9-12-15-18(21)22/h5,8,10-11,13-14,16-17,19-20H,2-4,6-7,9,12,15H2,1H3,(H,21,22)/b8-5+,13-10-,14-11-/t16-,17-/m1/s1
InChIKeyDVKUEUADFHEKNX-UAKIAEEZSA-N
Species of MetaboliteComponentSourceComments
Zea mays (ncbitaxon:4577) leaf (BTO:0000713) MetaboLights (MTBLS2566)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Dihydroxy-octadecatrienoate (CHEBI:176394) is a octadecatrienoic acid (CHEBI:25633)
IUPAC Name 
(6E,8Z,10R,11R,12Z)-10,11-dihydroxyoctadeca-6,8,12-trienoic acid
Manual XrefsDatabases
4943539ChemSpider
Registry NumbersSources
CAS:121979-39-3ChemIDplus