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CHEBI:138572 - N-(eicosanoyl)-hexadecasphing-4-enine-1-phosphocholine

ChEBI IDCHEBI:138572
ChEBI NameN-(eicosanoyl)-hexadecasphing-4-enine-1-phosphocholine
Stars
ASCII NameN-(eicosanoyl)-hexadecasphing-4-enine-1-phosphocholine
Last Modified28 September 2017
Submittermwilliams
DownloadsMolfile
FormulaC41H83N2O6P
Net Charge0
Average Mass731.097
Monoisotopic Mass730.59888
SMILES[H][C@@](O)(/C=C/CCCCCCCCCCC)[C@]([H])(COP(=O)([O-])OCC[N+](C)(C)C)NC(=O)CCCCCCCCCCCCCCCCCCC
InChIInChI=1S/C41H83N2O6P/c1-6-8-10-12-14-16-18-19-20-21-22-23-25-27-29-31-33-35-41(45)42-39(38-49-50(46,47)48-37-36-43(3,4)5)40(44)34-32-30-28-26-24-17-15-13-11-9-7-2/h32,34,39-40,44H,6-31,33,35-38H2,1-5H3,(H-,42,45,46,47)/b34-32+/t39-,40+/m0/s1
InChIKeyCYAOJEYKBPRRNW-YJFXYUILSA-N
ChEBI Ontology
Outgoing Relation(s)
N-(eicosanoyl)-hexadecasphing-4-enine-1-phosphocholine (CHEBI:138572) is a sphingomyelin 36:1 (CHEBI:72518)
Synonym  Source
SM(d16:1/20:0)LIPID MAPS
Manual XrefsDatabases
LMSP03010052LIPID MAPS