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CHEBI:88096 - N-hexanoylphytosphingosine 1-phosphate(2−)

ChEBI IDCHEBI:88096
ChEBI NameN-hexanoylphytosphingosine 1-phosphate(2−)
Stars
ASCII NameN-hexanoylphytosphingosine 1-phosphate(2-)
DefinitionAn anionic phospholipid obtained by deprotonation of the phosphate OH groups of N-hexanoylphytosphingosine 1-phosphate; major species at pH 7.3.
Last Modified8 October 2020
SubmitterAnneNiknejad
DownloadsMolfile
FormulaC24H48NO7P
Net Charge-2
Average Mass493.622
Monoisotopic Mass493.31794
SMILESCCCCCCCCCCCCCC[C@@H](O)[C@@H](O)[C@H](COP(=O)([O-])[O-])NC(=O)CCCCC
InChIInChI=1S/C24H50NO7P/c1-3-5-7-8-9-10-11-12-13-14-15-17-18-22(26)24(28)21(20-32-33(29,30)31)25-23(27)19-16-6-4-2/h21-22,24,26,28H,3-20H2,1-2H3,(H,25,27)(H2,29,30,31)/p-2/t21-,22+,24-/m0/s1
InChIKeyUDPBJAJIZZTTJS-ZDXQCDESSA-L
ChEBI Ontology
Outgoing Relation(s)
N-hexanoylphytosphingosine 1-phosphate(2−) (CHEBI:88096) is a N-acylphytosphingosine 1-phosphate(2−) (CHEBI:133525)
N-hexanoylphytosphingosine 1-phosphate(2−) (CHEBI:88096) is conjugate base of N-hexanoylphytosphingosine 1-phosphate (CHEBI:90165)
Incoming Relation(s)
N-hexanoylphytosphingosine 1-phosphate (CHEBI:90165) is conjugate acid of N-hexanoylphytosphingosine 1-phosphate(2−) (CHEBI:88096)
IUPAC Name 
(2S,3S,4R)-2-(hexanoylamino)-3,4-dihydroxyoctadecyl phosphate
Synonym  Source
N-hexanoyl-4-hydroxysphinganine 1-phosphate(2−)ChEBI
UniProt Name  Source
N-hexanoyl-(4R)-hydroxysphinganine-1-phosphateUniProt
Citations