α-Ketoglutaric acid - CAS 328-50-7
Catalog: |
BB021435 |
Product Name: |
α-Ketoglutaric acid |
CAS: |
328-50-7 |
Synonyms: |
2-oxopentanedioic acid |
Related CAS: | 64-15-3 (free base)
|
IUPAC Name: | 2-oxopentanedioic acid |
Description: | α-Ketoglutaric acid (CAS# 328-50-7) is a derivative of glutaric acid and is an intermediate in the kreb's cycle catalyzed by glutamate dehydrogenase enzyme on glutamate. |
Molecular Weight: | 146.10 |
Molecular Formula: | C5H6O5 |
Canonical SMILES: | C(CC(=O)O)C(=O)C(=O)O |
InChI: | InChI=1S/C5H6O5/c6-3(5(9)10)1-2-4(7)8/h1-2H2,(H,7,8)(H,9,10) |
InChI Key: | KPGXRSRHYNQIFN-UHFFFAOYSA-N |
Melting Point: | 113-115 °C |
Purity: | 95 % |
Solubility: | 541.5 mg/mL |
Appearance: | Crystalline |
Storage: | 2-8 °C |
MDL: | MFCD00004165 |
LogP: | -0.49510 |
GHS Hazard Statement: | H315 (53.71%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P332+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
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PMID | Publication Date | Title | Journal |
33781819 | 20210701 | Targeting SLC1A5 blocks cell proliferation through inhibition of mTORC1 in arsenite-treated human uroepithelial cells | Toxicology letters |
32720192 | 20200901 | Discovery of treatment for nerve agents targeting a new metabolic pathway | Archives of toxicology |
32293880 | 20200720 | Comparison of the Base Excision and Direct Reversal Repair Pathways for Correcting 1,N6-Ethenoadenine in Strongly Positioned Nucleosome Core Particles | Chemical research in toxicology |
31857147 | 20200601 | Epigallocatechin-3-gallate downregulates PDHA1 interfering the metabolic pathways in human herpesvirus 8 harboring primary effusion lymphoma cells | Toxicology in vitro : an international journal published in association with BIBRA |
32272012 | 20200508 | Disruption of the Plasmodium falciparum Life Cycle through Transcriptional Reprogramming by Inhibitors of Jumonji Demethylases | ACS infectious diseases |
Complexity: | 171 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 146.02152329 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 146.02152329 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 91.7 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.9 |
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