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CHEBI:196589 - 15:6(2Z,4E,6Z,8E,12E,14)(6Me,8Me,10Me[S],13Me)

ChEBI IDCHEBI:196589
ChEBI Name15:6(2Z,4E,6Z,8E,12E,14)(6Me,8Me,10Me[S],13Me)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H26O2
Net Charge0
Average Mass286.415
Monoisotopic Mass286.19328
SMILESC=C/C(C)=C/C[C@H](C)/C=C(C)/C=C(C)\C=C\C=C/C(=O)O
InChIInChI=1S/C19H26O2/c1-6-15(2)11-12-17(4)14-18(5)13-16(3)9-7-8-10-19(20)21/h6-11,13-14,17H,1,12H2,2-5H3,(H,20,21)/b9-7+,10-8-,15-11+,16-13-,18-14+/t17-/m0/s1
InChIKeySKOXKKRJJGFOTR-UYBOVOCXSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
15:6(2Z,4E,6Z,8E,12E,14)(6Me,8Me,10Me[S],13Me) (CHEBI:196589) is a long-chain fatty acid (CHEBI:15904)
IUPAC Name 
(2Z,4E,6Z,8E,10S,12E)-6,8,10,13-tetramethylpentadeca-2,4,6,8,12,14-hexaenoic acid
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