Compound: 2-Oxopentanedioic acid
SMILES: O=C(O)C(=O)CCC(=O)O
InChIKey: KPGXRSRHYNQIFN-UHFFFAOYSA-N
Synonyms: 2-Oxopentanedioic acid, 328-50-7, 2-oxoglutaric acid, alpha-ketoglutaric acid, 2-oxoglutarate, Oxoglutaric acid, a-ketoglutaric acid, 2-Oxo-1,5-pentanedioic acid, Pentanedioic acid, 2-oxo-, Alphaketoglutaric acid, oxogluric acid, Glutaric acid, 2-oxo-, Glutaric acid, alpha keto, ketoglutaric acid, alpha ketoglutaric acid, NSC-17391, DTXSID5033179, 8ID597Z82X, A-KETOGLUTARICUM ACIDUM, DTXCID3013179, CHEBI:30915, 2 Oxoglutaric Acid, 2 Ketoglutaric Acid, hydron;2-oxopentanedioate, RefChem:555767, 206-330-3, 2-ketoglutaric acid, Oxoglutarate, alpha-Oxoglutaric acid, alpha Ketoglutarate, Oxoglurate, Pentanedioic acid, oxo-, 2-ketoglutarate, Bis(L-arginin)-2-oxoglutarat, Oxoglurate [INN], MFCD00004165, .alpha.-Ketoglutaric acid, AI3-26938, 378-50-7, NSC 17391, 2-oxo-pentanedioic acid, alpha-keto-Glutaric acid, NSC17391, .alpha.-Oxoglutaric acid, CHEMBL1686, 34410-46-3, Glutaric acid, 2-oxo- (8CI), 2-Oxo-Glutaric Acid, 2-oxopentanedionate, 2-Ketoglutaricacid, AKG, CAS-328-50-7, 2-oxo-pentanedioicaci, alpha-Oxopentanedioic acid, EINECS 206-330-3, alpha-Ketoglutaricum acidum, alpha-Ketoglutaric acid alpha, UNII-8ID597Z82X, 3ouj, 4nro, 4oct, 4qkd, 4usi, keto glutaric acid, 2-oxoglutaric-acid, .alpha.-ketoglutarate, alpha-oxo-glutaric acid, alpha -ketoglutaric acid, 2-Oxo-1,5-pentanedioate, bmse000064, bmse000801, bmse000937, SCHEMBL7400, NCIStruc1_001710, NCIStruc2_000215, ALFA-KETOGLUTARIC ACID, Glutaric acid, .alpha.-keto-, GTPL3636, orb1301373, orb3141172, SCHEMBL2989030, SCHEMBL4368042, 2-Ketoglutaric acid (standard), OXOGLURIC ACID [MART.], OXOGLURIC ACID [WHO-DD], MSK2080, HY-W013636R, NCI17391, Pentanedioic acid, 2-oxo- (9CI), Tox21_110016, Tox21_200918, BBL010614, BDBM50303766, CCG-37641, EBC-03122, NCGC00013225, s6237, SBB056419, STK002174, 2-OXOPENTANEDIOIC ACID [FHFI], A-KETOGLUTARICUM ACIDUM [HPUS], AKOS000120908, CS-W014352, DB02926, DB03806, DB08845, FK09820, HY-W013636, .ALPHA.-KETOGLUTARIC ACID [MI], NCGC00013225-01, NCGC00013225-02, NCGC00013225-03, NCGC00013225-04, NCGC00013225-05, NCGC00013225-06, NCGC00090946-01, NCGC00090946-02, NCGC00258472-01, alpha-Ketoglutaric acid, >=99.0% (T), AS-12579, NCI60_001411, SY004310, DB-048280, K0005, NS00013803, ST45138045, EN300-18049, C00026, D70548, K-2400, SBI-0053864.0002, AB00640269-03, F069250, Q306140, alpha-Ketoglutaric acid, >=98.5% (NaOH, titration), BRD-K89712525-001-02-1, Z57127547, F2191-0182, | inverted exclamation mark-Ketoglutaric Acid Sodium Salt, 15118487-024F-412C-9995-24E8E6CA72EF, InChI=1/C5H6O5/c6-3(5(9)10)1-2-4(7)8/h1-2H2,(H,7,8)(H,9,10, alpha-Ketoglutaric acid, BioReagent, suitable for cell culture, suitable for insect cell culture
Theoretical properties:
molecular_formula: C5H6O5
molecular_weight: 146.10 g/mol
exact_mass: 146.02152329 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 2
hydrogen_bond_acceptor_count: 5
rotatable_bond_count: 4
heavy_atom_count: 10
topological_polar_surface_area: 91.7 Å²
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
Descriptions:
{"pubchem": "2-oxoglutaric acid is an oxo dicarboxylic acid that consists of glutaric acid bearing an oxo substituent at position 2. It is an intermediate metabolite in Krebs cycle. It has a role as a fundamental metabolite. It is functionally related to a glutaric acid. It is a conjugate acid of a 2-oxoglutarate(1-).", "chebi": "An oxo dicarboxylic acid that consists of glutaric acid bearing an oxo substituent at position 2. It is an intermediate metabolite in Krebs cycle.", "chembl": "ALPHA-KETOGLUTARIC ACID is a small molecule listed in the ChEMBL database but has not progressed to an approved clinical phase.", "wikipedia": "\u03b1-Ketoglutaric acid (AKG) is an organic compound with the formula HO2CCO(CH2)2CO2H.  A white, nontoxic solid, it is a common dicarboxylic acid.  Relevant to its biological roles, it exists in water as its conjugate base  \u03b1-ketoglutarate.  It is also classified as a 2-ketocarboxylic acid.  \u03b2-Ketoglutaric acid is an isomer. \"Ketoglutaric acid\" and \"ketoglutarate\", when not qualified as \u03b1 or \u03b2, almost always refers respectively to \u03b1-ketoglutaric acid or \u03b1-ketoglutarate.\n\u03b1-Ketoglutarate is an intermediate in the citric acid cycle, a set of cyclic reactions that supplies energy to cells. It is also an intermediate in or product of several other metabolic pathways. These include its being a component of metabolic pathways that: make amino acids and in the process regulate the cellular levels of carbon, nitrogen, and ammonia; reduce the cellular levels of potentially toxic reactive oxygen species; and synthesize the neurotransmitter \u03b3-aminobutyric acid (GABA).\nA large body of preclinical (i.e., conducted in animal models of disease or on animal or human tissues) research has been conducted on the role of endogenous (generated within the body) \u03b1-ketoglutarate. A small amount of preclinical research has been done to determine the effects of providing additional exogenous \u03b1-ketoglutarate to biological systems.  There is currently no randomized controlled trials showing \u03b1-ketoglutarate to have any pharmacological (drug-like) effects on humans. The Food and Drug Administration classifies \u03b1-ketoglutaric acid as \"503A Category 3: Bulk Drug Substances Nominated Without Adequate Support\".\n\n"}