CHEBI:84487 - N-oleoylsphingosine-1-phosphocholine

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ChEBI Name N-oleoylsphingosine-1-phosphocholine
ChEBI ID CHEBI:84487
ChEBI ASCII Name N-oleoylsphingosine-1-phosphocholine
Definition A N-octadecenolsphingosine-1-phosphocholine in which the acyl group specified is 9Z-octadecenoyl.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C41H81N2O6P
Net Charge 0
Average Mass 729.06540
Monoisotopic Mass 728.58323
InChI InChI=1S/C41H81N2O6P/c1-6-8-10-12-14-16-18-20-21-23-25-27-29-31-33-35-41(45)42-39(38-49-50(46,47)48-37-36-43(3,4)5)40(44)34-32-30-28-26-24-22-19-17-15-13-11-9-7-2/h20-21,32,34,39-40,44H,6-19,22-31,33,35-38H2,1-5H3,(H-,42,45,46,47)/b21-20-,34-32+/t39-,40+/m0/s1
InChIKey NBEADXWAAWCCDG-QDDWGVBQSA-N
SMILES CCCCCCCCCCCCC\C=C\[C@@H](O)[C@H](COP([O-])(=O)OCC[N+](C)(C)C)NC(=O)CCCCCCC\C=C/CCCCCCCC
Metabolite of Species Details
Mus musculus (NCBI:txid10090) See: MetaboLights Study
Roles Classification
Biological Role(s): mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing N-oleoylsphingosine-1-phosphocholine (CHEBI:84487) has functional parent oleic acid (CHEBI:16196)
N-oleoylsphingosine-1-phosphocholine (CHEBI:84487) has role mouse metabolite (CHEBI:75771)
N-oleoylsphingosine-1-phosphocholine (CHEBI:84487) is a sphingomyelin d18:1/18:1 (CHEBI:85593)
Synonyms Sources
N-(9Z-octadecenoyl)-sphing-4-enine-1-phosphocholine LIPID MAPS
N-(9Z-octadecenoyl)-sphingosine-1-phosphocholine ChEBI
SM(d18:1/18:1(9Z)) LIPID MAPS
Manual Xrefs Databases
HMDB0012101 HMDB
LMSP03010029 LIPID MAPS
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Last Modified
23 October 2015