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CHEBI:138573 - N-(11Z-eicosenoyl)-hexadecasphing-4-enine-1-phosphocholine

ChEBI IDCHEBI:138573
ChEBI NameN-(11Z-eicosenoyl)-hexadecasphing-4-enine-1-phosphocholine
Stars
ASCII NameN-(11Z-eicosenoyl)-hexadecasphing-4-enine-1-phosphocholine
Last Modified28 September 2017
Submittermwilliams
DownloadsMolfile
FormulaC41H81N2O6P
Net Charge0
Average Mass729.081
Monoisotopic Mass728.58322
SMILES[H][C@@](O)(/C=C/CCCCCCCCCCC)[C@]([H])(COP(=O)([O-])OCC[N+](C)(C)C)NC(=O)CCCCCCCCC/C=C\CCCCCCCC
InChIInChI=1S/C41H81N2O6P/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/h19-20,32,34,39-40,44H,6-18,21-31,33,35-38H2,1-5H3,(H-,42,45,46,47)/b20-19-,34-32+/t39-,40+/m0/s1
InChIKeyYTBRKOHFRDWGKO-XZNYDZQTSA-N
ChEBI Ontology
Outgoing Relation(s)
N-(11Z-eicosenoyl)-hexadecasphing-4-enine-1-phosphocholine (CHEBI:138573) is a sphingomyelin 36:2 (CHEBI:72519)
Synonym  Source
SM(d16:1/20:1)LIPID MAPS
Manual XrefsDatabases
LMSP03010048LIPID MAPS