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CHEBI:89177 - PC(20:3(8Z,11Z,14Z)/16:0)

ChEBI IDCHEBI:89177
ChEBI NamePC(20:3(8Z,11Z,14Z)/16:0)
Stars
DownloadsMolfile
FormulaC44H82NO8P
Net Charge0
Average Mass784.113
Monoisotopic Mass783.57781
SMILES[H][C@@](COC(=O)CCCCCC/C=C\C/C=C\C/C=C\CCCCC)(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCC
InChIInChI=1S/C44H82NO8P/c1-6-8-10-12-14-16-18-20-21-22-23-25-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-24-19-17-15-13-11-9-7-2/h14,16,20-21,23,25,42H,6-13,15,17-19,22,24,26-41H2,1-5H3/b16-14-,21-20-,25-23-/t42-/m1/s1
InChIKeyYKSVDDIMSQYNID-YYQUKWHJSA-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(20:3(8Z,11Z,14Z)/16:0) (CHEBI:89177) is a 1,2-diacyl-sn-glycero-3-phosphocholine (CHEBI:57643)
Synonyms  Source
GPCho(20:3w6/16:0)HMDB
(2-{[(2R)-2-(hexadecanoyloxy)-3-[(8Z,11Z,14Z)-icosa-8,11,14-trienoyloxy]propyl phosphonato]oxy}ethyl)trimethylazaniumHMDB
PC(20:3/16:0)HMDB
PC(20:3w6/16:0)HMDB
1-Homo-g-linolenoyl-2-palmitoyl-sn-glycero-3-phosphocholineHMDB
1-Homo-gamma-linolenoyl-2-palmitoyl-sn-glycero-3-phosphocholineHMDB
Manual XrefsDatabases
HMDB0008397HMDB
LecithinWikipedia
PHOSPHATIDYLCHOLINEMetaCyc
Citations