CHEBI:73000 - 1-hexadecanoyl-2-octadecanoyl-sn-glycero-3-phosphocholine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 1-hexadecanoyl-2-octadecanoyl-sn-glycero-3-phosphocholine
ChEBI ID CHEBI:73000
ChEBI ASCII Name 1-hexadecanoyl-2-octadecanoyl-sn-glycero-3-phosphocholine
Definition A phosphatidylcholine 34:0 in which the 1- and 2-acyl groups are specified as hexadecanoyl (palmitoyl) and octadecanoyl (stearoyl) respectively.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter abridge
Supplier Information
Download Molfile XML SDF
Formula C42H84NO8P
Net Charge 0
Average Mass 762.09200
Monoisotopic Mass 761.59346
InChI InChI=1S/C42H84NO8P/c1-6-8-10-12-14-16-18-20-21-23-25-27-29-31-33-35-42(45)51-40(39-50-52(46,47)49-37-36-43(3,4)5)38-48-41(44)34-32-30-28-26-24-22-19-17-15-13-11-9-7-2/h40H,6-39H2,1-5H3/t40-/m1/s1
InChIKey PZNPLUBHRSSFHT-RRHRGVEJSA-N
SMILES [H][C@@](COC(=O)CCCCCCCCCCCCCCC)(COP([O-])(=O)OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCCCC
Metabolite of Species Details
Mus musculus (NCBI:txid10090) See: MetaboLights Study
Roles Classification
Biological Role(s): 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.
(via phosphatidylcholine 34:0 )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 1-hexadecanoyl-2-octadecanoyl-sn-glycero-3-phosphocholine (CHEBI:73000) has functional parent hexadecanoic acid (CHEBI:15756)
1-hexadecanoyl-2-octadecanoyl-sn-glycero-3-phosphocholine (CHEBI:73000) has functional parent octadecanoic acid (CHEBI:28842)
1-hexadecanoyl-2-octadecanoyl-sn-glycero-3-phosphocholine (CHEBI:73000) has role mouse metabolite (CHEBI:75771)
1-hexadecanoyl-2-octadecanoyl-sn-glycero-3-phosphocholine (CHEBI:73000) is a phosphatidylcholine 34:0 (CHEBI:66855)
IUPAC Name
(2R)-3-(hexadecanoyloxy)-2-(octadecanoyloxy)propyl 2-(trimethylazaniumyl)ethyl phosphate
Synonyms Sources
(2R)-3-(palmitoyloxy)-2-(stearoyloxy)propyl 2-(trimethylammonio)ethyl phosphate IUPAC
1-hexadecanoyl-2-octadecanoyl-sn-glycero-3-phosphocholine UniProt
1-palmitoyl-2-stearoyl-GPC ChEBI
1-palmitoyl-2-stearoyl-GPC (16:0/18:0) ChEBI
1-palmitoyl-2-stearoyl-sn-glycero-3-phosphorylcholine SUBMITTER
1-palmitoyl-2-stearoylphosphatidylcholine LIPID MAPS
GPC(16:0/18:0) ChEBI
GPCho(16:0/18:0) HMDB
GPCho(34:0) HMDB
PC(16:0/18:0) SUBMITTER
PC(34:0) HMDB
Phosphatidylcholine(16:0/18:0) HMDB
Phosphatidylcholine(34:0) HMDB
Manual Xrefs Databases
HMDB0007970 HMDB
LMGP01010573 LIPID MAPS
View more database links
Registry Number Type Source
6258557 Reaxys Registry Number Reaxys
Last Modified
05 October 2016