RefMet Compound Details

RefMet ID, RefMet name, exact mass and formula
RefMet ID	RM0133189
RefMet name	Glucuronolactone
Systematic name	(3R,3aR,6R,6aR)-2,3,6-tris(oxidanyl)-3,3a,6,6a-tetrahydro-2H-furo[3,2-b]furan-5-one
Synonyms	PubChem Synonyms
Exact mass	176.032090 (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	C6H8O6	View other entries in RefMet with this formula
Molecular descriptors
Molfile	51214 (Download molfile/View MW Metabolite Database details)
InChI	InChI=1S/C6H8O6/c7-1-3-4(12-5(1)9)2(8)6(10)11-3/h1-5,7-9H/t1-,2-,3-,4-,5?/m1/s1
InChIKey	UYUXSRADSPPKRZ-SKNVOMKLSA-N	View other enantiomers/diastereomers of this metabolite in RefMet
SMILES	C(=O)[C@@H]([C@@H]1[C@@H]([C@@H](C(=O)O1)O)O)O Run Tanimoto similarity search (with similarity coefficient >=0.6)
Chemical/Biochemical Classification
Super Class	Carbohydrates
Main Class	Monosaccharides
Sub Class	Hexoses
Distribution of Glucuronolactone 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 Glucuronolactone
External Links
Pubchem CID	92283
ChEBI ID	18268
KEGG ID	C02670
HMDB ID	HMDB0006355
Spectral data for Glucuronolactone standards
NP-MRD ID(NMR)	View NMR spectra
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 Glucuronolactone

Rxn ID	KEGG Reaction	Enzyme
R02957	D-Glucuronolactone + NAD+ + 2 H2O <=> D-Glucarate + NADH + H+	D-Glucuronolactone:NAD+ oxidoreductase

Table of KEGG human pathways containing Glucuronolactone

Pathway ID	Human Pathway	# of reactions
hsa00053	Ascorbate and aldarate metabolism	1