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CHEBI:88737 - PC(22:1(13Z)/20:0)

ChEBI IDCHEBI:88737
ChEBI NamePC(22:1(13Z)/20:0)
Stars
DownloadsMolfile
FormulaC50H98NO8P
Net Charge0
Average Mass872.307
Monoisotopic Mass871.70301
SMILES[H][C@@](COC(=O)CCCCCCCCCCC/C=C\CCCCCCCC)(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCCCCCC
InChIInChI=1S/C50H98NO8P/c1-6-8-10-12-14-16-18-20-22-24-25-27-28-30-32-34-36-38-40-42-49(52)56-46-48(47-58-60(54,55)57-45-44-51(3,4)5)59-50(53)43-41-39-37-35-33-31-29-26-23-21-19-17-15-13-11-9-7-2/h20,22,48H,6-19,21,23-47H2,1-5H3/b22-20-/t48-/m1/s1
InChIKeyGHUGFCZMTRWVKH-RURDTVAGSA-N
Wikipedia
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) saliva (UBERON:0001836) Article (Dame, ZT. et al. (2014) The Human Saliva Metabolome (manuscript in preparation))
ChEBI Ontology
Outgoing Relation(s)
PC(22:1(13Z)/20:0) (CHEBI:88737) is a 1,2-diacyl-sn-glycero-3-phosphocholine (CHEBI:57643)
Synonyms  Source
GPCho(22:1n9/20:0)HMDB
LecithinHMDB
Phosphatidylcholine(22:1/20:0)HMDB
GPCho(42:1)HMDB
PC aa C42:1HMDB
1-Erucoyl-2-arachidonyl-sn-glycero-3-phosphocholineHMDB
Manual XrefsDatabases
HMDB0008569HMDB
PHOSPHATIDYLCHOLINEMetaCyc
LecithinWikipedia