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CHEBI:187946 - 16:3(2E,10E,12E)(3Me,5Me[R],7My,15Me)

ChEBI IDCHEBI:187946
ChEBI Name16:3(2E,10E,12E)(3Me,5Me[R],7My,15Me)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H32O2
Net Charge0
Average Mass304.474
Monoisotopic Mass304.24023
SMILESC=C(CC/C=C/C=C/CC(C)C)C[C@@H](C)C/C(C)=C/C(=O)O
InChIInChI=1S/C20H32O2/c1-16(2)11-9-7-6-8-10-12-17(3)13-18(4)14-19(5)15-20(21)22/h6-9,15-16,18H,3,10-14H2,1-2,4-5H3,(H,21,22)/b8-6+,9-7+,19-15+/t18-/m1/s1
InChIKeyXQIKRXUJLGQAKM-DNIQSHCLSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood plasma (BTO:0000131) MetaboLights (MTBLS2224)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
16:3(2E,10E,12E)(3Me,5Me[R],7My,15Me) (CHEBI:187946) is a long-chain fatty acid (CHEBI:15904)
IUPAC Name 
(2E,5R,10E,12E)-3,5,15-trimethyl-7-methylidenehexadeca-2,10,12-trienoic acid
Manual XrefsDatabases
113369091ChemSpider
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