CHEBI:86176 - 1-octadecanoyl-2-[(5Z,8Z,11Z)-eicosatrienoyl]-sn-glycero-3-phosphocholine

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ChEBI Name 1-octadecanoyl-2-[(5Z,8Z,11Z)-eicosatrienoyl]-sn-glycero-3-phosphocholine
ChEBI ID CHEBI:86176
ChEBI ASCII Name 1-octadecanoyl-2-[(5Z,8Z,11Z)-eicosatrienoyl]-sn-glycero-3-phosphocholine
Definition A phosphatidylcholine 36:3 in which the acyl groups at positions 1 and 2 are specified as octadecanoyl and (5Z,8Z,11Z)-icosatrienoyl respectively.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C46H86NO8P
Net Charge 0
Average Mass 812.152
Monoisotopic Mass 811.60911
InChI InChI=1S/C46H86NO8P/c1-6-8-10-12-14-16-18-20-22-23-25-27-29-31-33-35-37-39-46(49)55-44(43-54-56(50,51)53-41-40-47(3,4)5)42-52-45(48)38-36-34-32-30-28-26-24-21-19-17-15-13-11-9-7-2/h20,22,25,27,31,33,44H,6-19,21,23-24,26,28-30,32,34-43H2,1-5H3/b22-20-,27-25-,33-31-/t44-/m1/s1
InChIKey QXDDDGCNWRUEFM-UMKMFDOBSA-N
SMILES [C@@H](COC(CCCCCCCCCCCCCCCCC)=O)(COP(OCC[N+](C)(C)C)(=O)[O-])OC(CCC/C=C\C/C=C\C/C=C\CCCCCCCC)=O
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via phosphatidylcholine 38:3 )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 1-octadecanoyl-2-[(5Z,8Z,11Z)-eicosatrienoyl]-sn-glycero-3-phosphocholine (CHEBI:86176) has functional parent (5Z,8Z,11Z)-icosatrienoic acid (CHEBI:72865)
1-octadecanoyl-2-[(5Z,8Z,11Z)-eicosatrienoyl]-sn-glycero-3-phosphocholine (CHEBI:86176) has functional parent octadecanoic acid (CHEBI:28842)
1-octadecanoyl-2-[(5Z,8Z,11Z)-eicosatrienoyl]-sn-glycero-3-phosphocholine (CHEBI:86176) is a 1-stearoyl-2-icosatrienoyl-sn-glycero-3-phosphocholine (CHEBI:133633)
Synonyms Sources
1-stearoyl-2-meadoyl-GPC ChEBI
1-stearoyl-2-meadoyl-GPC (18:0/20:3n9) ChEBI
1-Stearoyl-2-meadoyl-sn-glycero-3-phosphocholine HMDB
GPC(18:0/20:3n9) ChEBI
GPCho(18:0/20:3) HMDB
GPCho(18:0/20:3n9) HMDB
GPCho(18:0/20:3w9) HMDB
PC(18:0/20:3(5Z,8Z,11Z)) LIPID MAPS
PC(18:0/20:3) HMDB
PC(18:0/20:3n9) HMDB
PC(18:0/20:3w9) HMDB
PC(38:3) HMDB
Phosphatidylcholine(18:0/20:3) HMDB
Phosphatidylcholine(18:0/20:3n9) HMDB
Phosphatidylcholine(18:0/20:3w9) HMDB
Phosphatidylcholine(38:3) HMDB
Manual Xrefs Databases
HMDB0008046 HMDB
LMGP01010796 LIPID MAPS
View more database links
Citation Waiting for Citations Type Source
24023812 PubMed citation Europe PMC
Last Modified
07 October 2016