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CHEBI:86197 - 1-hexadecanoyl-2-[(15Z)-tetracosenoyl]-sn-glycero-3-phosphocholine

ChEBI IDCHEBI:86197
ChEBI Name1-hexadecanoyl-2-[(15Z)-tetracosenoyl]-sn-glycero-3-phosphocholine
Stars
ASCII Name1-hexadecanoyl-2-[(15Z)-tetracosenoyl]-sn-glycero-3-phosphocholine
DefinitionA phosphatidylcholine 40:1 in which the acyl groups specified at positions 1 and 2 are hexadecanoyl and (15Z)-tetracosenoyl respectively.
Last Modified29 June 2015
Submitternamrata
DownloadsMolfile
FormulaC48H94NO8P
Net Charge0
Average Mass844.253
Monoisotopic Mass843.67171
SMILESCCCCCCCC/C=C\CCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C
InChIInChI=1S/C48H94NO8P/c1-6-8-10-12-14-16-18-20-21-22-23-24-25-26-27-29-31-33-35-37-39-41-48(51)57-46(45-56-58(52,53)55-43-42-49(3,4)5)44-54-47(50)40-38-36-34-32-30-28-19-17-15-13-11-9-7-2/h20-21,46H,6-19,22-45H2,1-5H3/b21-20-/t46-/m1/s1
InChIKeyXUCOLWONUSFHRC-QFQSVWFISA-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-hexadecanoyl-2-[(15Z)-tetracosenoyl]-sn-glycero-3-phosphocholine (CHEBI:86197) has functional parent (15Z)-tetracosenoic acid (CHEBI:44247)
1-hexadecanoyl-2-[(15Z)-tetracosenoyl]-sn-glycero-3-phosphocholine (CHEBI:86197) has functional parent hexadecanoic acid (CHEBI:15756)
1-hexadecanoyl-2-[(15Z)-tetracosenoyl]-sn-glycero-3-phosphocholine (CHEBI:86197) is a phosphatidylcholine 40:1 (CHEBI:66865)
IUPAC Name 
(2R)-3-(hexadecanoyloxy)-2-{[(15Z)-tetracos-15-enoyl]oxy}propyl 2-(trimethylazaniumyl)ethyl phosphate
Synonyms  Source
PC(16:0/24:1(15Z))LIPID MAPS
Phosphatidylcholine(16:0/24:1n9)HMDB
Phosphatidylcholine(16:0/24:1w9)HMDB
GPCho(16:0/24:1n9)HMDB
1-Palmitoyl-2-nervonoyl-sn-glycero-3-phosphocholineHMDB
GPCho(16:0/24:1w9)HMDB
Manual XrefsDatabases
LMGP01010659LIPID MAPS
HMDB0007993HMDB