PC(P-18:1(11Z)/20:3(8Z,11Z,14Z)) (CHEBI:89923)

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CHEBI:89923 - PC(P-18:1(11Z)/20:3(8Z,11Z,14Z))

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ChEBI ID	CHEBI:89923
ChEBI Name	PC(P-18:1(11Z)/20:3(8Z,11Z,14Z))
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Downloads	Molfile

Formula	C46H84NO7P
Net Charge	0
Average Mass	794.152
Monoisotopic Mass	793.59854
SMILES	[H][C@@](CO/C=C\CCCCCCCC/C=C\CCCCCC)(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCC/C=C\C/C=C\C/C=C\CCCCC
InChI	InChI=1S/C46H84NO7P/c1-6-8-10-12-14-16-18-20-22-24-25-27-29-31-33-35-37-39-46(48)54-45(44-53-55(49,50)52-42-40-47(3,4)5)43-51-41-38-36-34-32-30-28-26-23-21-19-17-15-13-11-9-7-2/h14,16-17,19-20,22,25,27,38,41,45H,6-13,15,18,21,23-24,26,28-37,39-40,42-44H2,1-5H3/b16-14-,19-17-,22-20-,27-25-,41-38-/t45-/m1/s1
InChIKey	DBQMOXDLWKVKKG-REWQMPQJSA-N

Species of Metabolite	Component	Source	Comments
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(P-18:1(11Z)/20:3(8Z,11Z,14Z)) (CHEBI:89923) is a glycerophosphocholine (CHEBI:36313)

Synonyms	Source
1-(1-Enyl-vaccenoyl)-2-homo-g-linolenoyl-sn-glycero-3-phosphocholine	HMDB
Phosphatidylcholine(38:4)	HMDB
GPCho(18:1w7/20:3w6)	HMDB
PC(18:1w7/20:3w6)	HMDB
PC(38:4)	HMDB
(2-{[(2R)-2-[(8Z,11Z,14Z)-icosa-8,11,14-trienoyloxy]-3-[(1Z,11Z)-octadeca-1,11-dien-1-yloxy]propyl phosphonato]oxy}ethyl)trimethylazanium	HMDB

Manual Xrefs	Databases
HMDB0011285	HMDB

Citations