Metabolomics Structure Database

MDLMOL SDF CSV TSV

MW REGNO:	37330
Common Name:	D-2-Hydroxyglutaric acid
Systematic Name:	(2R)-2-hydroxypentanedioic acid
RefMet Name:	D-2-Hydroxyglutaric acid
Synonyms:	[PubChem Synonyms]
Exact Mass:	148.0372 (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-H+2K]+ [M+Na]+ [M+2Na]2+ [M-H+2Na]+ [M+Li]+ [M+2Li]2+ [M+NH4]+ [M-H]- [M-2H]2- [M-3H]3- [M-4H]4- [M+Cl]- [M+OAc]- [M+HCOO]- M(neutral)
Formula:	C5H8O5
InChIKey:	HWXBTNAVRSUOJR-GSVOUGTGSA-N
LIPID MAPS Category:	Fatty Acyls
LIPID MAPS mainclass:	Fatty acids
LIPID MAPS subclass:	Dicarboxylic acids
SMILES:	C(CC(=O)O)[C@H](C(=O)O)O
Studies:	Available studies (via RefMet name)

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All Database Links Calculated Properties Human Pathways

External database links:

PubChem CID:	439391
CHEBI ID:	32796
HMDB ID:	HMDB0000606
KEGG ID:	C01087
Chemspider ID:	388508
METLIN ID:	5581
MetaCyc ID:	R-2-HYDROXYGLUTARATE
EPA CompTox DB:	DTXCID20812889
Plant Metabolite Hub(Pmhub):	MS000006729

References

LIPID MAPS classification: "Update of the LIPID MAPS comprehensive classification system for lipids", Fahy E, Subramaniam S, Murphy RC, Nishijima M, Raetz CR, Shimizu T, Spener F, van Meer G, Wakelam MJ, and Dennis EA, J. Lipid Res. (2009) 50: S9-S14. DOI: 10.1194/jlr.R800095-JLR200
ClassyFire classification: "ClassyFire: automated chemical classification with a comprehensive, computable taxonomy", Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS, J. Cheminformatics (2016) 8:61. DOI: 10.1186/s13321-016-0174-y