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CHEBI:168099 - 12-hydroxy-8E,10E-heptadecadienoic acid

ChEBI IDCHEBI:168099
ChEBI Name12-hydroxy-8E,10E-heptadecadienoic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H30O3
Net Charge0
Average Mass282.424
Monoisotopic Mass282.21949
SMILESCCCCCC(O)/C=C/C=C/CCCCCCC(=O)O
InChIInChI=1S/C17H30O3/c1-2-3-10-13-16(18)14-11-8-6-4-5-7-9-12-15-17(19)20/h6,8,11,14,16,18H,2-5,7,9-10,12-13,15H2,1H3,(H,19,20)/b8-6+,14-11+
InChIKeyINVCGLRLLKLTGP-SIGMCMEVSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
12-hydroxy-8E,10E-heptadecadienoic acid (CHEBI:168099) is a long-chain fatty acid (CHEBI:15904)
IUPAC Name 
(8E,10E)-12-hydroxyheptadeca-8,10-dienoic acid
Manual XrefsDatabases
4472189ChemSpider
LMFA01050194LIPID MAPS
Registry NumbersSources
CAS:15514-88-2ChemIDplus