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CHEBI:72605 - tetranor-12R-HETE

ChEBI IDCHEBI:72605
ChEBI Nametetranor-12R-HETE
Stars
ASCII Nametetranor-12R-HETE
DefinitionA polyunsaturated fatty acid that consists of 4Z,6E,10Z-hexadecatrienoic acid bearing an additional 8R-hydroxy substituent.
Last Modified5 March 2018
Submittermwilliams
DownloadsMolfile
FormulaC16H26O3
Net Charge0
Average Mass266.381
Monoisotopic Mass266.18819
SMILESCCCCC/C=C\C[C@@H](O)/C=C/C=C\CCC(=O)O
InChIInChI=1S/C16H26O3/c1-2-3-4-5-6-9-12-15(17)13-10-7-8-11-14-16(18)19/h6-10,13,15,17H,2-5,11-12,14H2,1H3,(H,18,19)/b8-7-,9-6-,13-10+/t15-/m1/s1
InChIKeyKBOVKDIBOBQLRS-QCNAHCIUSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
tetranor-12R-HETE (CHEBI:72605) has role metabolite (CHEBI:25212)
tetranor-12R-HETE (CHEBI:72605) is a hydroxy polyunsaturated fatty acid (CHEBI:140345)
tetranor-12R-HETE (CHEBI:72605) is a long-chain fatty acid (CHEBI:15904)
IUPAC Name 
(4Z,6E,8R,10Z)-8-hydroxyhexadeca-4,6,10-trienoic acid
Manual XrefsDatabases
LMFA01050143LIPID MAPS
Registry NumbersSources
Reaxys:4312446Reaxys