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CHEBI:82959 - N-hexanoylsphingosine 1-phosphate(2−)

ChEBI IDCHEBI:82959
ChEBI NameN-hexanoylsphingosine 1-phosphate(2−)
Stars
ASCII NameN-hexanoylsphingosine 1-phosphate(2-)
DefinitionA ceramide 1-phosphate(2−) in which the ceramide N-acyl group is specified as hexanoyl; major species at pH 7.3.
Last Modified20 November 2014
SubmitterAnneNiknejad
DownloadsMolfile
FormulaC24H46NO6P
Net Charge-2
Average Mass475.607
Monoisotopic Mass475.30737
SMILESCCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](COP(=O)([O-])[O-])NC(=O)CCCCC
InChIInChI=1S/C24H48NO6P/c1-3-5-7-8-9-10-11-12-13-14-15-16-18-19-23(26)22(21-31-32(28,29)30)25-24(27)20-17-6-4-2/h18-19,22-23,26H,3-17,20-21H2,1-2H3,(H,25,27)(H2,28,29,30)/p-2/b19-18+/t22-,23+/m0/s1
InChIKeyUHXNGRCUFWVQPN-QFWQFVLDSA-L
Roles Classification
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
N-hexanoylsphingosine 1-phosphate(2−) (CHEBI:82959) is a N-acylsphingosine 1-phosphate(2−) (CHEBI:57674)
N-hexanoylsphingosine 1-phosphate(2−) (CHEBI:82959) is conjugate base of N-hexanoylsphingosine 1-phosphate (CHEBI:83798)
Incoming Relation(s)
N-hexanoylsphingosine 1-phosphate (CHEBI:83798) is conjugate acid of N-hexanoylsphingosine 1-phosphate(2−) (CHEBI:82959)
IUPAC Name 
(2S,3R,4E)-2-(hexanoylamino)-3-hydroxyoctadec-4-en-1-yl phosphate
Synonym  Source
CerP(d18:1/6:0)SUBMITTER
UniProt Name  Source
N-hexanoylsphing-4-enine 1-phosphateUniProt
Citations