RefMet Compound Details

RefMet ID, RefMet name, exact mass and formula
RefMet ID	RM0136157
RefMet name	6-Lactoyltetrahydropterin
Systematic name	2-amino-6-(2-hydroxypropanoyl)-3,4,5,6,7,8-hexahydropteridin-4-one
Synonyms	PubChem Synonyms
Exact mass	239.101840 (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	C9H13N5O3	View other entries in RefMet with this formula
Molecular descriptors
Molfile	38004 (Download molfile/View MW Metabolite Database details)
InChI	InChI=1S/C9H13N5O3/c1-3(15)6(16)4-2-11-7-5(12-4)8(17)14-9(10)13-7/h3-4,12,15H,2H2,1H3,(H4,10,11,13,14,17)
InChIKey	HKCYZTKHPLJZDR-UHFFFAOYSA-N	View other enantiomers/diastereomers of this metabolite in RefMet
SMILES	CC(C(=O)C1CNc2c(c(=O)[nH]c(N)n2)N1)O Run Tanimoto similarity search (with similarity coefficient >=0.6)
Chemical/Biochemical Classification
Super Class	Organoheterocyclic compounds
Main Class	Pterins
Sub Class	Pterins
Distribution of 6-Lactoyltetrahydropterin 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 6-Lactoyltetrahydropterin
External Links
Pubchem CID	135398702
ChEBI ID	17248
KEGG ID	C04244
HMDB ID	HMDB0002065
Chemspider ID	148245
MetaCyc ID	6-LACTOYL-5678-TETRAHYDROPTERIN
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 6-Lactoyltetrahydropterin

Rxn ID	KEGG Reaction	Enzyme
R01813	Tetrahydrobiopterin + NADP+ <=> 6-Lactoyl-5,6,7,8-tetrahydropterin + NADPH + H+	tetrahydrobiopterin:NADP+ oxidoreductase
R04285	6-Lactoyl-5,6,7,8-tetrahydropterin + NADP+ <=> 6-Pyruvoyltetrahydropterin + NADPH + H+	6-Lactoyl-5,6,7,8-tetrahydropterin:NADP+ 2'-oxidoreductase

Table of KEGG human pathways containing 6-Lactoyltetrahydropterin

Pathway ID	Human Pathway	# of reactions
hsa00790	Folate biosynthesis	2