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CHEBI:85378 - N-oleoylsphingosine 1-phosphate(2−)

ChEBI IDCHEBI:85378
ChEBI NameN-oleoylsphingosine 1-phosphate(2−)
Stars
ASCII NameN-oleoylsphingosine 1-phosphate(2-)
DefinitionAn N-acylsphingosine 1-phosphate(2−) in which the N-acyl group is specified as oleoyl; major species at pH 7.3.
Last Modified26 May 2015
Submitterlaimo
DownloadsMolfile
FormulaC36H68NO6P
Net Charge-2
Average Mass641.915
Monoisotopic Mass641.47952
SMILESCCCCCCCC/C=C\CCCCCCCC(=O)N[C@@H](COP(=O)([O-])[O-])[C@H](O)/C=C/CCCCCCCCCCCCC
InChIInChI=1S/C36H70NO6P/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-36(39)37-34(33-43-44(40,41)42)35(38)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h17-18,29,31,34-35,38H,3-16,19-28,30,32-33H2,1-2H3,(H,37,39)(H2,40,41,42)/p-2/b18-17-,31-29+/t34-,35+/m0/s1
InChIKeyHOOJDMQIUTXSPU-RHPAUOISSA-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-oleoylsphingosine 1-phosphate(2−) (CHEBI:85378) is a N-acylsphingosine 1-phosphate(2−) (CHEBI:57674)
N-oleoylsphingosine 1-phosphate(2−) (CHEBI:85378) is conjugate base of N-oleoylsphingosine 1-phosphate (CHEBI:85882)
Incoming Relation(s)
N-oleoylsphingosine 1-phosphate (CHEBI:85882) is conjugate acid of N-oleoylsphingosine 1-phosphate(2−) (CHEBI:85378)
IUPAC Name 
(2S,3R,4E)-3-hydroxy-2-{[(9Z)-octadec-9-enoyl]amino}octadec-4-en-1-yl phosphate
Synonyms  Source
Cer-1-P(d18:1/18:1n-9)(2−)SUBMITTER
C-18:1n-9-C1P(2−)SUBMITTER
N-oleoylsphing-4-enine 1-phosphate(2−)ChEBI
UniProt Name  Source
N-(9Z-octadecenoyl)-sphing-4-enine-1-phosphateUniProt
Citations