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CHEBI:89597 - PC(18:2(9Z,12Z)/18:1(9Z))

ChEBI IDCHEBI:89597
ChEBI NamePC(18:2(9Z,12Z)/18:1(9Z))
Stars
Last Modified17 December 2020
DownloadsMolfile
FormulaC44H82NO8P
Net Charge0
Average Mass784.113
Monoisotopic Mass783.57781
SMILES[H][C@@](COC(=O)CCCCCCC/C=C\C/C=C\CCCCC)(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\CCCCCCCC
InChIInChI=1S/C44H82NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h14,16,20-23,42H,6-13,15,17-19,24-41H2,1-5H3/b16-14-,22-20-,23-21-/t42-/m1/s1
InChIKeyRTAZWRZKFSTMOY-NMSVECGZSA-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(18:2(9Z,12Z)/18:1(9Z)) (CHEBI:89597) is a 1,2-diacyl-sn-glycero-3-phosphocholine (CHEBI:57643)
Synonyms  Source
PC(18:2/18:1)HMDB
PC(18:2n6/18:1n9)HMDB
GPCho(18:2/18:1)HMDB
Phosphatidylcholine(18:2n6/18:1n9)HMDB
LecithinHMDB
GPCho(18:2n6/18:1n9)HMDB
UniProt Name  Source
1-(9Z,12Z-octadecadienoyl)-2-(9Z-octadecenoyl)-sn-glycero-3-phosphocholineUniProt
Manual XrefsDatabases
HMDB0008137HMDB
PHOSPHATIDYLCHOLINEMetaCyc
LecithinWikipedia
Citations