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CHEBI:88712 - PC(22:2(13Z,16Z)/14:1(9Z))

ChEBI IDCHEBI:88712
ChEBI NamePC(22:2(13Z,16Z)/14:1(9Z))
Stars
DownloadsMolfile
FormulaC44H82NO8P
Net Charge0
Average Mass784.113
Monoisotopic Mass783.57781
SMILES[H][C@@](COC(=O)CCCCCCCCCCC/C=C\C/C=C\CCCCC)(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\CCCC
InChIInChI=1S/C44H82NO8P/c1-6-8-10-12-14-16-18-19-20-21-22-23-24-25-27-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-26-17-15-13-11-9-7-2/h13-16,19-20,42H,6-12,17-18,21-41H2,1-5H3/b15-13-,16-14-,20-19-/t42-/m1/s1
InChIKeyAHJIOIOFNHUXKJ-GXAHKNHCSA-N
Wikipedia
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
urine (BTO:0001419) PubMed (24023812)
saliva (UBERON:0001836) Article (Dame, ZT. et al. (2014) The Human Saliva Metabolome (manuscript in preparation))
ChEBI Ontology
Outgoing Relation(s)
PC(22:2(13Z,16Z)/14:1(9Z)) (CHEBI:88712) is a 1,2-diacyl-sn-glycero-3-phosphocholine (CHEBI:57643)
Synonyms  Source
GPCho(36:3)HMDB
GPCho(22:2/14:1)HMDB
Phosphatidylcholine(36:3)HMDB
(2-{[(2R)-3-[(13Z,16Z)-docosa-13,16-dienoyloxy]-2-[(9Z)-tetradec-9-enoyloxy]propyl phosphonato]oxy}ethyl)trimethylazaniumHMDB
GPCho(22:2w6/14:1w5)HMDB
1-Docosadienoyl-2-myristoleoyl-sn-glycero-3-phosphocholineHMDB
Manual XrefsDatabases
LecithinWikipedia
HMDB0008591HMDB
PHOSPHATIDYLCHOLINEMetaCyc
Citations