RefMet Compound Details

RefMet ID, RefMet name, exact mass and formula
RefMet ID	RM0133370
RefMet name	LPC 0:0/20:4(5Z,8Z,11Z,14Z)
Synonyms	PubChem Synonyms
Sum Composition	LPC 20:4	View other entries in RefMet with this sum composition
Exact mass	543.3325 (neutral)	Calculate m/z: (Choose adduct) [M+H]+ [M+H-H2O]+ [M.]+ [M+2H]2+ [M+3H]3+ [M+4H]4+ [M+K]+ [M+2K]2+ [M+2K-H]+ [M+Na]+ [M+2Na]2+ [M+2Na-H]+ [M+Li]+ [M+2Li]2+ [M+NH4]+ [M.CH3]+ [M+Ag]+ [M+H+CH3OH]+ [M+H+CH3CN]+ [M+H+2CH3CN]+ [M+Na+CH3CN]+ [M.NaFormate+H]+ [M.NH4Formate+H]+ [M.TMSi]+ [M.tBuDMSi]+ [M+H-Hexose]+ [M+H-EtnP]+ [M+H-SerP]+ [M-H]- [M-H-H2O]- [M-CH3]- [M-2H]2- [M-3H]3- [M-4H]4- [M+Cl]- [M+OAc]- [M+Na-2H]- [M+K-2H]- [M.Formate]- [M.NaFormate-H]- [M.NH4Formate-H]- [M.F]- [M-H-Ser]- [M.HF2]- M(neutral)    View other RefMet entries with this exact (neutral) mass:   +/- 0.05 amu   +/- 0.1 amu   +/- 0.2 amu   +/- 0.5 amu
Formula	C28H50NO7P	View other entries in RefMet with this formula
Molecular descriptors
Molfile	15037 (Download molfile/View MW Metabolite Database details)
InChI
InChIKey	IGJKYDBBINVMLH-JXRLJXCWSA-N	View other enantiomers/diastereomers of this metabolite in RefMet
Chemical/Biochemical Classification
Super Class	Glycerophospholipids
Main Class	Glycerophosphocholines
Sub Class	LPC (Lysophosphatidylcholines)
Distribution of LPC 0:0/20:4(5Z,8Z,11Z,14Z) in NMDR studies
Species	Plot Species distribution
Sample source	Plot Sample source(tissue) distribution
Platform	Platform (MS/NMR) used for detection
Chromatography	Chromatography methods used for detection
Studies	NMDR Studies reporting LPC 0:0/20:4(5Z,8Z,11Z,14Z)
External Links
Pubchem CID	52924038
LIPID MAPS	LMGP01050121
ChEBI ID	76079
KEGG ID	C04233
HMDB ID	HMDB0061699
Structural annotation level
Annotation level	1   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)

Table of KEGG reactions in human pathways involving LPC 0:0/20:4(5Z,8Z,11Z,14Z)

Rxn ID	KEGG Reaction	Enzyme
R01316	Phosphatidylcholine + H2O <=> 2-Acyl-sn-glycero-3-phosphocholine + Fatty acid	phosphatidylcholine 1-acylhydrolase
R02747	2-Acyl-sn-glycero-3-phosphocholine + H2O <=> sn-Glycero-3-phosphocholine + Fatty acid	2-Acyl-sn-glycero-3-phosphocholine acylhydrolase

Table of KEGG human pathways containing LPC 0:0/20:4(5Z,8Z,11Z,14Z)

Pathway ID	Human Pathway	# of reactions
hsa00564	Glycerophospholipid metabolism	2