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

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name N-(11Z-eicosenoyl)-hexadecasphing-4-enine-1-phosphocholine
ChEBI ID CHEBI:138573
ChEBI ASCII Name N-(11Z-eicosenoyl)-hexadecasphing-4-enine-1-phosphocholine
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C41H81N2O6P
Net Charge 0
Average Mass 729.067
Monoisotopic Mass 728.58323
InChI InChI=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
InChIKey YTBRKOHFRDWGKO-XZNYDZQTSA-N
SMILES [C@]([C@@](/C=C/CCCCCCCCCCC)(O)[H])(NC(=O)CCCCCCCCC/C=C\CCCCCCCC)([H])COP(OCC[N+](C)(C)C)([O-])=O
ChEBI Ontology
Outgoing 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 Xref Database
LMSP03010048 LIPID MAPS
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Last Modified
28 September 2017