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CHEBI:72958 - N-decanoylsphingosine 1-phosphate(2−)

Default Structure
ChEBI IDCHEBI:72958
ChEBI NameN-decanoylsphingosine 1-phosphate(2−)
Stars
ASCII NameN-decanoylsphingosine 1-phosphate(2-)
DefinitionA N-acylsphingosine 1-phosphate(2−) in which the N-acyl group is specified as decanoyl.
Last Modified11 April 2013
SubmitterAlan Bridge
DownloadsMolfile
FormulaC28H54NO6P
Net Charge-2
Average Mass531.715
Monoisotopic Mass531.36997
SMILESCCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](COP(=O)([O-])[O-])NC(=O)CCCCCCCCC
InChIInChI=1S/C28H56NO6P/c1-3-5-7-9-11-12-13-14-15-16-18-19-21-23-27(30)26(25-35-36(32,33)34)29-28(31)24-22-20-17-10-8-6-4-2/h21,23,26-27,30H,3-20,22,24-25H2,1-2H3,(H,29,31)(H2,32,33,34)/p-2/b23-21+/t26-,27+/m0/s1
InChIKeyWQUGODXHDAKAMW-NBNLIBPQSA-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-decanoylsphingosine 1-phosphate(2−) (CHEBI:72958) is a N-acylsphingosine 1-phosphate(2−) (CHEBI:57674)
N-decanoylsphingosine 1-phosphate(2−) (CHEBI:72958) is conjugate base of N-decanoylsphingosine 1-phosphate (CHEBI:73147)
Incoming Relation(s)
N-decanoylsphingosine 1-phosphate (CHEBI:73147) is conjugate acid of N-decanoylsphingosine 1-phosphate(2−) (CHEBI:72958)
IUPAC Names 
(2S,3R,4E)-2-(decanoylamino)-3-hydroxyoctadec-4-en-1-yl dihydrogen phosphate
(2S,3R,4E)-2-(decanoylamino)-3-hydroxyoctadec-4-en-1-yl phosphate
Synonyms  Source
CerP(d18:1/10:0)SUBMITTER
N-(decanoyl)sphing-4-enine-1-phosphateSUBMITTER
N-decanoylsphing-4-enine-1-phosphateSUBMITTER