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CHEBI:194142 - 9-[(9Z),(12Z)-octadecadienoyloxy]-octadecanoate

ChEBI IDCHEBI:194142
ChEBI Name9-[(9Z),(12Z)-octadecadienoyloxy]-octadecanoate
Stars
ASCII Name9-[(9Z),(12Z)-octadecadienoyloxy]-octadecanoate
DefinitionA monocarboxylic acid anion that is the conjugate base of 9-[(9Z),(12Z)-octadecadienoyloxy]-octadecanoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Submitternhn
DownloadsMolfile
FormulaC36H65O4
Net Charge-1
Average Mass561.912
Monoisotopic Mass561.48883
SMILESCCCCC/C=C\C/C=C\CCCCCCCC(=O)OC(CCCCCCCCC)CCCCCCCC(=O)[O-]
InChIInChI=1S/C36H66O4/c1-3-5-7-9-11-12-13-14-15-16-17-18-20-25-29-33-36(39)40-34(30-26-22-19-10-8-6-4-2)31-27-23-21-24-28-32-35(37)38/h11-12,14-15,34H,3-10,13,16-33H2,1-2H3,(H,37,38)/p-1/b12-11-,15-14-
InChIKeyLRKBHXWTBBPDIN-HDXUUTQWSA-M
ChEBI Ontology
Outgoing Relation(s)
9-[(9Z),(12Z)-octadecadienoyloxy]-octadecanoate (CHEBI:194142) is a monocarboxylic acid anion (CHEBI:35757)
UniProt Name  Source
9-(9Z,12Z-octadecadienoyloxy)-octadecanoateUniProt
Citations