CHEBI:83360 - N-lignoceroylsphingosine-1-phosphocholine

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ChEBI Name N-lignoceroylsphingosine-1-phosphocholine
ChEBI ID CHEBI:83360
ChEBI ASCII Name N-lignoceroylsphingosine-1-phosphocholine
Definition A sphingomyelin d18:1 in which the ceramide N-acyl group is specified as lignoceroyl (tetracosanoyl).
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Lucila Aimo
Secondary ChEBI IDs CHEBI:85596
Supplier Information
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Formula C47H95N2O6P
Net Charge 0
Average Mass 815.24080
Monoisotopic Mass 814.69278
InChI InChI=1S/C47H95N2O6P/c1-6-8-10-12-14-16-18-20-21-22-23-24-25-26-27-29-31-33-35-37-39-41-47(51)48-45(44-55-56(52,53)54-43-42-49(3,4)5)46(50)40-38-36-34-32-30-28-19-17-15-13-11-9-7-2/h38,40,45-46,50H,6-37,39,41-44H2,1-5H3,(H-,48,51,52,53)/b40-38+/t45-,46+/m0/s1
InChIKey QEDPUVGSSDPBMD-XTAIVQBESA-N
SMILES CCCCCCCCCCCCCCCCCCCCCCCC(=O)N[C@@H](COP([O-])(=O)OCC[N+](C)(C)C)[C@H](O)\C=C\CCCCCCCCCCCCC
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-lignoceroylsphingosine-1-phosphocholine (CHEBI:83360) has functional parent tetracosanoic acid (CHEBI:28866)
N-lignoceroylsphingosine-1-phosphocholine (CHEBI:83360) has role mouse metabolite (CHEBI:75771)
N-lignoceroylsphingosine-1-phosphocholine (CHEBI:83360) is a sphingomyelin 42:1 (CHEBI:72533)
N-lignoceroylsphingosine-1-phosphocholine (CHEBI:83360) is a sphingomyelin d18:1 (CHEBI:17636)
IUPAC Name
(2S,3R,4E)-3-hydroxy-2-(tetracosanoylamino)octadec-4-en-1-yl 2-(trimethylazaniumyl)ethyl phosphate
Synonyms Sources
(2S,3R,4E)-3-hydroxy-2-(tetracosanoylamino)octadec-4-en-1-yl 2-(trimethylammonio)ethyl phosphate IUPAC
C24 Sphingomyelin LIPID MAPS
N-(tetracosanoyl)-sphing-4-enine-1-phosphocholine UniProt
N-lignoceroylsphing-4-enine-1-phosphocholine ChEBI
N-tetracosanoylsphing-4-enine-1-phosphocholine ChEBI
N-tetracosanoylsphingosine-1-phosphocholine SUBMITTER
SM(d18:1/24:0) LIPID MAPS
SPH(d18:1/24:0) HMDB
sphingomyelin (d18:1/24:0) SUBMITTER
Manual Xrefs Databases
HMDB0011697 HMDB
LMSP03010008 LIPID MAPS
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Registry Number Type Source
6789055 Reaxys Registry Number Reaxys
Last Modified
23 October 2015