CHEBI:137851 - PC(20:5(5Z,8Z,11Z,14Z,17Z)/22:5(7Z,10Z,13Z,16Z,19Z))

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name PC(20:5(5Z,8Z,11Z,14Z,17Z)/22:5(7Z,10Z,13Z,16Z,19Z))
ChEBI ID CHEBI:137851
ChEBI ASCII Name PC(20:5(5Z,8Z,11Z,14Z,17Z)/22:5(7Z,10Z,13Z,16Z,19Z))
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C50H80NO8P
Net Charge 0
Average Mass 854.148
Monoisotopic Mass 853.56216
InChI InChI=1S/C50H80NO8P/c1-6-8-10-12-14-16-18-20-22-24-25-27-29-31-33-35-37-39-41-43-50(53)59-48(47-58-60(54,55)57-45-44-51(3,4)5)46-56-49(52)42-40-38-36-34-32-30-28-26-23-21-19-17-15-13-11-9-7-2/h8-11,14-17,20-23,25,27-28,30-31,33-34,36,48H,6-7,12-13,18-19,24,26,29,32,35,37-47H2,1-5H3/b10-8-,11-9-,16-14-,17-15-,22-20-,23-21-,27-25-,30-28-,33-31-,36-34-/t48-/m1/s1
InChIKey KJZGPYYLCQSOIZ-IHSLHUTLSA-N
SMILES [C@](COC(=O)CCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC)(OC(=O)CCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC)([H])COP(OCC[N+](C)(C)C)([O-])=O
ChEBI Ontology
Outgoing PC(20:5(5Z,8Z,11Z,14Z,17Z)/22:5(7Z,10Z,13Z,16Z,19Z)) (CHEBI:137851) is a 1,2-diacyl-sn-glycero-3-phosphocholine (CHEBI:57643)
Synonym Source
1-(5Z,8Z,11Z,14Z,17Z-eicosapentaenoyl)-2-(7Z,10Z,13Z,16Z,19Z-docosapentaenoyl)-sn-glycero-3-phosphocholine LIPID MAPS
Manual Xrefs Databases
HMDB0008517 HMDB
LMGP01011058 LIPID MAPS
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Last Modified
13 July 2017