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CHEBI:73138 - N-docosanoylsphingosine-1-phosphate

ChEBI IDCHEBI:73138
ChEBI NameN-docosanoylsphingosine-1-phosphate
Stars
ASCII NameN-docosanoylsphingosine-1-phosphate
DefinitionA ceramide 1-phosphate that is the N-docosanoyl derivative of sphingosine.
Last Modified11 April 2013
SubmitterSteve
DownloadsMolfile
FormulaC40H80NO6P
Net Charge0
Average Mass702.055
Monoisotopic Mass701.57233
SMILESCCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](COP(=O)(O)O)NC(=O)CCCCCCCCCCCCCCCCCCCCC
InChIInChI=1S/C40H80NO6P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-26-28-30-32-34-36-40(43)41-38(37-47-48(44,45)46)39(42)35-33-31-29-27-25-23-16-14-12-10-8-6-4-2/h33,35,38-39,42H,3-32,34,36-37H2,1-2H3,(H,41,43)(H2,44,45,46)/b35-33+/t38-,39+/m0/s1
InChIKeyZRTZYMMYLZPKEQ-GLQCRSEXSA-N
Roles Classification
Biological Role:
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
ChEBI Ontology
Outgoing Relation(s)
N-docosanoylsphingosine-1-phosphate (CHEBI:73138) has functional parent docosanoic acid (CHEBI:28941)
N-docosanoylsphingosine-1-phosphate (CHEBI:73138) has functional parent sphingosine (CHEBI:16393)
N-docosanoylsphingosine-1-phosphate (CHEBI:73138) is a N-acylsphingosine 1-phosphate (CHEBI:16197)
N-docosanoylsphingosine-1-phosphate (CHEBI:73138) is conjugate acid of N-docosanoylsphingosine-1-phosphate(2−) (CHEBI:72969)
Incoming Relation(s)
N-docosanoylsphingosine-1-phosphate(2−) (CHEBI:72969) is conjugate base of N-docosanoylsphingosine-1-phosphate (CHEBI:73138)
IUPAC Name 
(2S,3R,4E)-2-(docosanoylamino)-3-hydroxyoctadec-4-en-1-yl dihydrogen phosphate
Synonyms  Source
CerP(d18:1/22:0)LIPID MAPS
N-(docosanoyl)sphing-4-enine 1-phosphateChEBI
Manual XrefsDatabases
HMDB0010703HMDB
LMSP02050006LIPID MAPS