RefMet Compound Details

RefMet ID, RefMet name, exact mass and formula
RefMet ID	RM0008252
RefMet name	PC P-18:0/18:1 or PC O-18:1/18:1
Alternative name	PC(P-18:0/18:1)/PC(O-18:1/18:1)
Sum Composition	PC O-36:2	View other entries in RefMet with this sum composition
Exact mass	771.614192 (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	C44H86NO7P	View other entries in RefMet with this formula
Chemical/Biochemical Classification
Super Class	Glycerophospholipids
Main Class	Glycerophosphocholines
Sub Class	O-PC (Ether Phosphatidylcholines)
Distribution of PC P-18:0/18:1 or PC O-18:1/18:1 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 PC P-18:0/18:1 or PC O-18:1/18:1
External Links
KEGG ID	C00958
Structural annotation level
Annotation level	3   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)

Abbrev	# of Studies	Refmet name(exact structures)	Systematic name
PC O-36:2	3	PC O-16:0/20:2(11Z,14Z)	1-hexadecyl-2-(11Z,14Z-eicosadienoyl)-glycero-3-phosphocholine
PC O-36:2			1-octadecyl-2-(9Z,12Z-octadecadienoyl)-glycero-3-phosphocholine
PC O-36:2			1-(9Z-octadecenyl)-2-(11Z-octadecenoyl)-sn-glycero-3-phosphocholine