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CHEBI:58796 - (9S,10S)-10-hydroxy-9-(phosphonatooxy)octadecanoate

ChEBI IDCHEBI:58796
ChEBI Name(9S,10S)-10-hydroxy-9-(phosphonatooxy)octadecanoate
Stars
ASCII Name(9S,10S)-10-hydroxy-9-(phosphonatooxy)octadecanoate
DefinitionTrianion of (9S,10S)-10-hydroxy-9-(phosphonooxy)octadecanoic acid arising from deprotonation of carboxylic acid and phosphate functions.
Last Modified5 June 2018
DownloadsMolfile
FormulaC18H34O7P
Net Charge-3
Average Mass393.437
Monoisotopic Mass393.20586
SMILESCCCCCCCC[C@H](O)[C@H](CCCCCCCC(=O)[O-])OP(=O)([O-])[O-]
InChIInChI=1S/C18H37O7P/c1-2-3-4-5-7-10-13-16(19)17(25-26(22,23)24)14-11-8-6-9-12-15-18(20)21/h16-17,19H,2-15H2,1H3,(H,20,21)(H2,22,23,24)/p-3/t16-,17-/m0/s1
InChIKeyUELBXEKQONEDKM-IRXDYDNUSA-K
ChEBI Ontology
Outgoing Relation(s)
(9S,10S)-10-hydroxy-9-(phosphonatooxy)octadecanoate (CHEBI:58796) is a hydroxy monocarboxylic acid anion (CHEBI:36059)
(9S,10S)-10-hydroxy-9-(phosphonatooxy)octadecanoate (CHEBI:58796) is a organophosphate oxoanion (CHEBI:58945)
(9S,10S)-10-hydroxy-9-(phosphonatooxy)octadecanoate (CHEBI:58796) is conjugate base of (9S,10S)-10-hydroxy-9-(phosphonooxy)octadecanoic acid (CHEBI:49253)
Incoming Relation(s)
(9S,10S)-10-hydroxy-9-(phosphonooxy)octadecanoic acid (CHEBI:49253) is conjugate acid of (9S,10S)-10-hydroxy-9-(phosphonatooxy)octadecanoate (CHEBI:58796)
Synonym  Source
(9S,10S)-10-hydroxy-9-(phosphonatooxy)stearateChEBI
UniProt Name  Source
(9S,10S)-10-hydroxy-9-(phosphooxy)octadecanoateUniProt