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CHEBI:89601 - PC(18:2(9Z,12Z)/16:1(9Z))

Default Structure
ChEBI IDCHEBI:89601
ChEBI NamePC(18:2(9Z,12Z)/16:1(9Z))
Stars
Last Modified21 September 2017
DownloadsMolfile
FormulaC42H78NO8P
Net Charge0
Average Mass756.059
Monoisotopic Mass755.54651
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\CCCCCC
InChIInChI=1S/C42H78NO8P/c1-6-8-10-12-14-16-18-20-21-23-24-26-28-30-32-34-41(44)48-38-40(39-50-52(46,47)49-37-36-43(3,4)5)51-42(45)35-33-31-29-27-25-22-19-17-15-13-11-9-7-2/h14,16-17,19-21,40H,6-13,15,18,22-39H2,1-5H3/b16-14-,19-17-,21-20-/t40-/m1/s1
InChIKeyPPCVNZFMCABQCL-KXESGEQTSA-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))
Roles Classification
Biological Role:
Caenorhabditis elegans metabolite  A nematode metabolite produced by Caenorhabditis elegans.
ChEBI Ontology
Outgoing Relation(s)
PC(18:2(9Z,12Z)/16:1(9Z)) (CHEBI:89601) is a 1,2-diacyl-sn-glycero-3-phosphocholine (CHEBI:57643)
PC(18:2(9Z,12Z)/16:1(9Z)) (CHEBI:89601) is a PC(18:2/16:1) (CHEBI:138447)
Synonyms  Source
1-Linoleoyl-2-palmitoleoyl-sn-glycero-3-phosphocholineHMDB
(2-{[(2R)-2-[(9Z)-hexadec-9-enoyloxy]-3-[(9Z,12Z)-octadeca-9,12-dienoyloxy]propyl phosphonato]oxy}ethyl)trimethylazaniumHMDB
GPCho(18:2/16:1)HMDB
GPCho(18:2n6/16:1n7)HMDB
GPCho(18:2w6/16:1w7)HMDB
GPCho(34:3)HMDB
Manual XrefsDatabases
HMDB0008134HMDB
LecithinWikipedia
PHOSPHATIDYLCHOLINEMetaCyc
Citations