CHEBI:133636 - 1-(1Z-hexadecenyl)-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphocholine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 1-(1Z-hexadecenyl)-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphocholine
ChEBI ID CHEBI:133636
ChEBI ASCII Name 1-(1Z-hexadecenyl)-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphocholine
Definition A 1-(Z)-alk-1-enyl-2-acyl-sn-glycero-3-phosphocholine in which the alk-1-enyl and acyl groups are specified as (1Z)-hexadecenyl and (4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl respectively.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:89987
Supplier Information
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Formula C46H80NO7P
Net Charge 0
Average Mass 790.105
Monoisotopic Mass 789.56724
InChI InChI=1S/C46H80NO7P/c1-6-8-10-12-14-16-18-20-22-23-24-25-26-27-29-31-33-35-37-39-46(48)54-45(44-53-55(49,50)52-42-40-47(3,4)5)43-51-41-38-36-34-32-30-28-21-19-17-15-13-11-9-7-2/h8,10,14,16,20,22,24-25,27,29,33,35,38,41,45H,6-7,9,11-13,15,17-19,21,23,26,28,30-32,34,36-37,39-40,42-44H2,1-5H3/b10-8-,16-14-,22-20-,25-24-,29-27-,35-33-,41-38-/t45-/m1/s1
InChIKey QICWUUGBNFIZAZ-KMPUTSBYSA-N
SMILES [C@@H](OC(CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC)=O)(CO/C=C\CCCCCCCCCCCCCC)COP(OCC[N+](C)(C)C)(=O)[O-]
ChEBI Ontology
Outgoing 1-(1Z-hexadecenyl)-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphocholine (CHEBI:133636) is a 1-(Z)-alk-1-enyl-2-acyl-sn-glycero-3-phosphocholine (CHEBI:77286)
1-(1Z-hexadecenyl)-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphocholine (CHEBI:133636) is a phosphatidylcholine P-38:6 (CHEBI:132590)
IUPAC Name
(2R)-2-{[(4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoyl]oxy}-3-{[(1Z)-hexadec-1-en-1-yl]oxy}propyl 2-(trimethylazaniumyl)ethyl phosphate
Synonyms Sources
1-(1-enyl-palmitoyl)-2-docosahexaenoyl-GPC ChEBI
1-(1-enyl-palmitoyl)-2-docosahexaenoyl-GPC (P-16:0/22:6) ChEBI
1-(1-Enyl-palmitoyl)-2-docosahexaenoyl-sn-glycero-3-phosphocholine HMDB
1-[(1Z)-hexadecenyl]-2-[(4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl]-sn-glycero-3-phosphocholine ChEBI
GPC(P-16:0/22:6) ChEBI
PC(16:0p/22:6) ChEBI
PC(P-16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) ChEBI
PC(P-16:0/22:6) ChEBI
Manual Xrefs Databases
HMDB0011229 HMDB
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Citation Waiting for Citations Type Source
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Last Modified
05 October 2016