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CHEBI:89994 - PC(O-24:0/18:3(9Z,12Z,15Z))

ChEBI IDCHEBI:89994
ChEBI NamePC(O-24:0/18:3(9Z,12Z,15Z))
Stars
Last Modified5 March 2020
DownloadsMolfile
FormulaC50H96NO7P
Net Charge0
Average Mass854.292
Monoisotopic Mass853.69244
SMILES[H][C@@](COCCCCCCCCCCCCCCCCCCCCCCCC)(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC
InChIInChI=1S/C50H96NO7P/c1-6-8-10-12-14-16-18-20-22-23-24-25-26-27-28-30-32-34-36-38-40-42-45-55-47-49(48-57-59(53,54)56-46-44-51(3,4)5)58-50(52)43-41-39-37-35-33-31-29-21-19-17-15-13-11-9-7-2/h9,11,15,17,21,29,49H,6-8,10,12-14,16,18-20,22-28,30-48H2,1-5H3/b11-9-,17-15-,29-21-/t49-/m1/s1
InChIKeyNIIFWBWRLRQUHB-LSTCNRAPSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
saliva (UBERON:0001836) Article (Dame, ZT. et al. (2014) The Human Saliva Metabolome (manuscript in preparation))
urine (BTO:0001419) PubMed (24023812)
ChEBI Ontology
Outgoing Relation(s)
PC(O-24:0/18:3(9Z,12Z,15Z)) (CHEBI:89994) is a 1-(1,2-saturated-acyl)-2-acyl-sn-glycerolipid (CHEBI:167498)
PC(O-24:0/18:3(9Z,12Z,15Z)) (CHEBI:89994) is a glycerophosphocholine (CHEBI:36313)
Synonyms  Source
GPCho(24:0/18:3n3)HMDB
PC(42:3)HMDB
PC(O-42:3)HMDB
GPCho(24:0/18:3)HMDB
PC ae C42:3HMDB
1-Lignoceryl-2-a-linolenoyl-sn-glycero-3-phosphocholineHMDB
Manual XrefsDatabases
HMDB0013459HMDB
Citations