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CHEBI:184140 - PC(20:1(11Z)/20:4(5Z,8Z,11Z,14Z))

Default Structure
ChEBI IDCHEBI:184140
ChEBI NamePC(20:1(11Z)/20:4(5Z,8Z,11Z,14Z))
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC48H86NO8P
Net Charge0
Average Mass836.189
Monoisotopic Mass835.60911
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)O[C@H](COC(=O)CCCCCCCCC/C=C\CCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C
InChIInChI=1S/C48H86NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-38-40-47(50)54-44-46(45-56-58(52,53)55-43-42-49(3,4)5)57-48(51)41-39-37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h15,17,20-23,27,29,33,35,46H,6-14,16,18-19,24-26,28,30-32,34,36-45H2,1-5H3/b17-15-,22-20-,23-21-,29-27-,35-33-/t46-/m1/s1
InChIKeyLJFKFKIYUJNFPZ-ZLFSCUDPSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) serum (BTO:0001239) MetaboLights (MTBLS3725)
ChEBI Ontology
Outgoing Relation(s)
PC(20:1(11Z)/20:4(5Z,8Z,11Z,14Z)) (CHEBI:184140) is a 1,2-diacyl-sn-glycero-3-phosphocholine (CHEBI:57643)
IUPAC Name 
[(2R)-2-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyl]oxy-3-[(Z)-icos-11-enoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphate
Manual XrefsDatabases
24766973ChemSpider
HMDB0008312HMDB
LMGP01011827LIPID MAPS