RefMet Compound Details

RefMet ID, RefMet name, exact mass and formula
RefMet ID	RM0073007
RefMet name	DiHETE
Sum Composition	FA 20:4;O2	View other entries in RefMet with this sum composition
Exact mass	336.230060 (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	C20H32O4	View other entries in RefMet with this formula
Chemical/Biochemical Classification
Super Class	Fatty Acyls
Main Class	Eicosanoids
Sub Class	HETE
Distribution of DiHETE 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 DiHETE
External Links
ChEBI ID	72868
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
FA 20:4;O2	87	LTB4	5S,12R-dihydroxy-6Z,8E,10E,14Z-eicosatetraenoic acid
FA 20:4;O2	33	17,18-DiHETE	(+/-)-17,18-dihydroxy-5Z,8Z,11Z,14Z-eicosatetraenoic acid
FA 20:4;O2	29	8,15-DiHETE	(5Z,9E,11Z,13E)-8,15-dihydroxyicosa-5,9,11,13-tetraenoic acid
FA 20:4;O2	28	14,15-DiHETE	(+/-)-14,15-dihydroxy-5Z,8Z,11Z,17Z-eicosatetraenoic acid
FA 20:4;O2	22	5,15-DiHETE	(6E,8Z,11Z,13E)-5,15-dihydroxyicosa-6,8,11,13-tetraenoic acid
FA 20:4;O2	21	6-trans-LTB4	5S,12R-dihydroxy-6E,8E,10E,14Z-eicosatetraenoic acid
FA 20:4;O2	15	PGB1	9-oxo-15S-hydroxy-8(12),13E-prostadienoic acid
FA 20:4;O2	10	12-epi-LTB4	5S,12S-dihydroxy-6Z,8E,10E,14Z-eicosatetraenoic acid
FA 20:4;O2	8	Hepoxilin A3	8-hydroxy-11S,12S-epoxy-5Z,14Z,9E-eicosatrienoic acid
FA 20:4;O2	8	PGA1	9-oxo-15S-hydroxy-10Z,13E-prostadienoic acid
FA 20:4;O2	7	12S-HpETE	12S-hydroperoxy-5Z,8Z,10E,14Z-eicosatetraenoic acid
FA 20:4;O2	7	15S-HpETE	15S-hydroperoxy-5Z,8Z,11Z,13E-eicosatetraenoic acid
FA 20:4;O2	6	11-Deoxy-PGE2	9-oxo-15S-hydroxy-5Z,13E-prostadienoic acid
FA 20:4;O2	5	5S,15S-DiHETE	5S,15S-dihydroxy-6E,8Z,11Z,13E-eicosatetraenoic acid
FA 20:4;O2	5	5S-HpETE	5S-hydroperoxy-6E,8Z,11Z,14Z-eicosatetraenoic acid
FA 20:4;O2	5	6-trans-12-epi-LTB4	5S,12S-dihydroxy-6E,8E,10E,14Z-eicosatetraenoic acid
FA 20:4;O2	4	11-HpETE	11-hydroperoxy-5Z,8Z,12E,14-eicosatetraenoic acid
FA 20:4;O2	4	Hepoxilin B3	10-hydroxy-11S,12S-epoxy-5Z,8Z,14Z-eicosatrienoic acid
FA 20:4;O2	3	8S,15S-DiHETE	8S,15S-dihydroxy-5Z,9E,11Z,13E-eicosatetraenoic acid
FA 20:4;O2	2	11,12-DiHETE	(+/-)-11,12-dihydroxy-5Z,8Z,14Z,17Z-eicosatetraenoic acid
FA 20:4;O2	2	5S,12S-DiHETE	5S,12S-dihydroxy-6E,8Z,10E,14Z-eicosatetraenoic acid
FA 20:4;O2	2	8,9-DiHETE	(+/-)-8,9-dihydroxy-5Z,11Z,14Z,17Z-eicosatetraenoic acid
FA 20:4;O2	2	8S-HpETE	8S-hydoperoxy-5Z,9E,11Z,14Z-eicosatetraenoic acid
FA 20:4;O2	1	11,12-Ep-15S-HETrE	11,12-epoxy-15S-hydroxy-5Z,8Z,13E-eicosatrienoic acid
FA 20:4;O2	1	11R-HpETE	11R-hydroperoxy-5Z,8Z,12E,14Z-eicosatetraenoic acid
FA 20:4;O2	1	12R-HpETE	12R-hydroperoxy-5Z,8Z,10E,14Z-eicosatetraenoic acid
FA 20:4;O2	1	5,12-DiHETE	5,12-dihydroxy-6,8,10,14-eicosatetraenoic acid
FA 20:4;O2	1	5S,15R-diHETE	5S,15R-dihydroxy-6E,8Z,11Z,13E-eicosatetraenoic acid
FA 20:4;O2	1	5S,6S-DiHETE	5S,6S-dihydroxy-7E,9E,11Z,14Z-eicosatetraenoic acid
FA 20:4;O2		11,12-Epoxy-8-hydroxyeicosa-5,9,14-trienoic acid	11R,12S-epoxy-8-hydroxy-5Z,9E,14Z-eicosatrienoic acid
FA 20:4;O2		14(15)-Ep-11-HETrE	11-hydroxy-14,15-epoxy-5Z,8Z,12E-eicosatrienoic acid
FA 20:4;O2		15-epi-PGA1	9-oxo-15R-hydroxy-10Z,13E-prostadienoic acid
FA 20:4;O2		5S,11R-DiHETE	5S,11R-dihydroxy-6E,8Z,12E,14Z-eicosatetraenoic acid
FA 20:4;O2		5S,6R-DiHETE	5S,6R-dihydroxy-7E,9E,11Z,14Z-eicosatetraenoic acid
FA 20:4;O2		8-iso-PGA1	9-oxo-15S-hydroxy-10Z,13E-prostadienoic acid-cyclo[8S,12S]
FA 20:4;O2		8R-HpETE	8R-hydroperoxy-5Z,9E,11Z,14Z-eicosatetraenoic acid
FA 20:4;O2		9-HpETE	9-hydroperoxy-5,7E,11Z,14Z-eicosatetraenoic acid
FA 20:4;O2		9S-HpETE	9S-hydroperoxy-5Z,7E,11Z,14Z-eicosatetraenoic acid
FA 20:4;O2		PGC1	9-oxo-15S-hydroxy-11Z,13E-prostadienoic acid