CHEBI:52897 - sphingosylphosphocholine acid

ChEBI IDCHEBI:52897
ChEBI Namesphingosylphosphocholine acid
Stars
DefinitionA cationic phosphosphingolipid consisting of sphingosine having a phosphocholine moiety attached to its primary hydroxyl group.
Last Modified21 November 2019
SubmitterSteve
DownloadsMolfile
FormulaC23H50N2O5P
Net Charge+1
Average Mass465.636
Monoisotopic Mass465.34519
SMILESCCCCCCCCCCCCC/C=C/[C@@H](O)[C@@H](N)COP(=O)(O)OCC[N+](C)(C)C
InChIInChI=1S/C23H49N2O5P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23(26)22(24)21-30-31(27,28)29-20-19-25(2,3)4/h17-18,22-23,26H,5-16,19-21,24H2,1-4H3/p+1/b18-17+/t22-,23+/m0/s1
InChIKeyJLVSPVFPBBFMBE-HXSWCURESA-O
ChEBI Ontology
Outgoing Relation(s)
sphingosylphosphocholine acid (CHEBI:52897) has functional parent sphingosine (CHEBI:16393)
sphingosylphosphocholine acid (CHEBI:52897) is a phosphocholines (CHEBI:36700)
sphingosylphosphocholine acid (CHEBI:52897) is a phosphosphingolipid (CHEBI:35786)
sphingosylphosphocholine acid (CHEBI:52897) is a quaternary ammonium ion (CHEBI:35267)
sphingosylphosphocholine acid (CHEBI:52897) is conjugate acid of sphingosine-1-phosphocholine (CHEBI:17689)
sphingosylphosphocholine acid (CHEBI:52897) is tautomer of sphingosine-1-phosphocholine(1+) (CHEBI:58906)
Incoming Relation(s)
sphingosine-1-phosphocholine (CHEBI:17689) is conjugate base of sphingosylphosphocholine acid (CHEBI:52897)
sphingosine-1-phosphocholine(1+) (CHEBI:58906) is tautomer of sphingosylphosphocholine acid (CHEBI:52897)
IUPAC Name 
2-{[{[(2S,3R,4E)-2-amino-3-hydroxyoctadec-4-en-1-yl]oxy}(hydroxy)phosphoryl]oxy}-N,N,N-trimethylethanaminium
Synonyms  Source
Sphingosyl-phosphocholineKEGG COMPOUND
Sphing-4-enine-1-phosphocholineLIPID MAPS
sphingosylphosphocholine acidChEBI
sphingosylphosphocholineChEBI
Manual XrefsDatabases
C03640KEGG COMPOUND
SPUPDBeChem