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CHEBI:74000 - 1-palmitoyl-2-palmitoleoyl-sn-glycero-3-phosphocholine

ChEBI IDCHEBI:74000
ChEBI Name1-palmitoyl-2-palmitoleoyl-sn-glycero-3-phosphocholine
Stars
ASCII Name1-palmitoyl-2-palmitoleoyl-sn-glycero-3-phosphocholine
DefinitionA phosphatidylcholine 32:1 in which the acyl groups at C-1 and C-2 are hexadecanoyl and (9Z)-hexadec-9-enoyl respectively.
Secondary ChEBI IDCHEBI:74907
Last Modified6 March 2017
Submitterabridge, laimo
DownloadsMolfile
FormulaC40H78NO8P
Net Charge0
Average Mass732.037
Monoisotopic Mass731.54651
SMILESCCCCCC/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C
InChIInChI=1S/C40H78NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-39(42)46-36-38(37-48-50(44,45)47-35-34-41(3,4)5)49-40(43)33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h17,19,38H,6-16,18,20-37H2,1-5H3/b19-17-/t38-/m1/s1
InChIKeyQIBZFHLFHCIUOT-NPBIGWJUSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) - MetaboLights (MTBLS143)
Roles Classification
Biological Roles:
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
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-palmitoyl-2-palmitoleoyl-sn-glycero-3-phosphocholine (CHEBI:74000) has functional parent hexadecanoic acid (CHEBI:15756)
1-palmitoyl-2-palmitoleoyl-sn-glycero-3-phosphocholine (CHEBI:74000) has functional parent palmitoleic acid (CHEBI:28716)
1-palmitoyl-2-palmitoleoyl-sn-glycero-3-phosphocholine (CHEBI:74000) has role mouse metabolite (CHEBI:75771)
1-palmitoyl-2-palmitoleoyl-sn-glycero-3-phosphocholine (CHEBI:74000) is a 1-acyl-2-palmitoleoyl-sn-glycero-3-phosphocholine (CHEBI:75240)
1-palmitoyl-2-palmitoleoyl-sn-glycero-3-phosphocholine (CHEBI:74000) is a phosphatidylcholine 32:1 (CHEBI:66849)
IUPAC Name 
(2R)-3-(hexadecanoyloxy)-2-[(9Z)-hexadec-9-enoyloxy]propyl 2-(trimethylazaniumyl)ethyl phosphate
Synonyms  Source
1-C16:0-2-C16:1(ω-7)-phosphatidylcholineSUBMITTER
1-hexadecanoyl-2-(9Z)-hexadecenoyl-sn-glycero-3-phosphocholineSUBMITTER
1-hexadecanoyl-2-(9Z-hexadecenoyl)-sn-glycero-3-phosphocholine zwitterionChEBI
1-hexadecanoyl-2-(9Z-hexadecenoyl)-sn-glycero-3-phosphocholineLIPID MAPS
1-palmitoyl-2-palmitoleoyl-GPCChEBI
1-palmitoyl-2-palmitoleoyl-GPC (16:0/16:1)ChEBI
UniProt Name  Source
1-hexadecanoyl-2-(9Z-hexadecenoyl)-sn-glycero-3-phosphocholineUniProt
Manual XrefsDatabases
HMDB0007969HMDB
LMGP01010566LIPID MAPS
Registry NumbersSources
Reaxys:6034659Reaxys
CAS:53595-24-7ChemIDplus