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CHEBI:86217 - 1-[(9Z)-octadecenoyl]-2-tetracosanoyl-sn-glycero-3-phosphocholine

ChEBI IDCHEBI:86217
ChEBI Name1-[(9Z)-octadecenoyl]-2-tetracosanoyl-sn-glycero-3-phosphocholine
Stars
ASCII Name1-[(9Z)-octadecenoyl]-2-tetracosanoyl-sn-glycero-3-phosphocholine
DefinitionA phosphatidylcholine 42:1 in which the acyl groups specified at positions 1 and 2 are (9Z)-octadecenoyl and tetracosanoyl respectively.
Last Modified23 October 2015
Submitternamrata
DownloadsMolfile
FormulaC50H98NO8P
Net Charge0
Average Mass872.307
Monoisotopic Mass871.70301
SMILESCCCCCCCC/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCCCCCCCCCC
InChIInChI=1S/C50H98NO8P/c1-6-8-10-12-14-16-18-20-22-23-24-25-26-27-29-31-33-35-37-39-41-43-50(53)59-48(47-58-60(54,55)57-45-44-51(3,4)5)46-56-49(52)42-40-38-36-34-32-30-28-21-19-17-15-13-11-9-7-2/h21,28,48H,6-20,22-27,29-47H2,1-5H3/b28-21-/t48-/m1/s1
InChIKeyFOWWMXZTRWYEGK-FQUFUIAJSA-N
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
1-[(9Z)-octadecenoyl]-2-tetracosanoyl-sn-glycero-3-phosphocholine (CHEBI:86217) has functional parent oleic acid (CHEBI:16196)
1-[(9Z)-octadecenoyl]-2-tetracosanoyl-sn-glycero-3-phosphocholine (CHEBI:86217) has functional parent tetracosanoic acid (CHEBI:28866)
1-[(9Z)-octadecenoyl]-2-tetracosanoyl-sn-glycero-3-phosphocholine (CHEBI:86217) is a phosphatidylcholine 42:1 (CHEBI:66970)
IUPAC Name 
(2R)-3-{[(9Z)-octadec-9-enoyl]oxy}-2-(tetracosanoyloxy)propyl 2-(trimethylazaniumyl)ethyl phosphate
Synonyms  Source
PC(18:1w9/24:0)HMDB
Phosphatidylcholine(18:1n9/24:0)HMDB
GPCho(18:1n9/24:0)HMDB
Phosphatidylcholine(18:1w9/24:0)HMDB
1-Oleoyl-2-lignoceroyl-sn-glycero-3-phosphocholineHMDB
PC(18:1n9/24:0)HMDB
Manual XrefsDatabases
LMGP01010915LIPID MAPS
HMDB0008124HMDB