3-carboxy-2,3-dideoxy-1-hydroxypropan-1,2,3-tricarboxylic acid
3-carboxy-2,3-dideoxy-1-hydroxypropan-1,2,3-tricarboxylic acid structure
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Common Name | 3-carboxy-2,3-dideoxy-1-hydroxypropan-1,2,3-tricarboxylic acid | ||
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| CAS Number | 320-77-4 | Molecular Weight | 192.12400 | |
| Density | 1.751g/cm3 | Boiling Point | 329.6ºC at 760 mmHg | |
| Molecular Formula | C6H8O7 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 167.4ºC | |
Use of 3-carboxy-2,3-dideoxy-1-hydroxypropan-1,2,3-tricarboxylic acidIsocitric acid is an endogenous metabolite present in Saliva and Cellular_Cytoplasm that can be used for the research of Alzheimer's Disease, Lewy Body Dementia and Anoxia[1][2][3]. |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | isocitric acid |
|---|---|
| Synonym | More Synonyms |
This table contains bioactivity, target information and biological‑assay experimental data of this compound.
| Description | Isocitric acid is an endogenous metabolite present in Saliva and Cellular_Cytoplasm that can be used for the research of Alzheimer's Disease, Lewy Body Dementia and Anoxia[1][2][3]. |
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| Related Catalog | |
| Target |
Human Endogenous Metabolite |
| In Vitro | Endogenous metabolites is defined as those that are annotated by Kyoto Encyclopedia of Genes and Genomes as substrates or products of the ~1900 metabolic enzymes encoded in our genome. It is clear in the body of literature that there are documented toxic properties for many of these metabolites[1]. |
| References |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 1.751g/cm3 |
|---|---|
| Boiling Point | 329.6ºC at 760 mmHg |
| Molecular Formula | C6H8O7 |
| Molecular Weight | 192.12400 |
| Flash Point | 167.4ºC |
| Exact Mass | 192.02700 |
| PSA | 132.13000 |
| Index of Refraction | 1.569 |
| InChIKey | ODBLHEXUDAPZAU-UHFFFAOYSA-N |
| SMILES | O=C(O)CC(C(=O)O)C(O)C(=O)O |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~98%
3-carboxy-2,3-d... CAS#:320-77-4 |
| Literature: Sugimura, Kenji; Kuwabata, Susumu; Yoneyama, Hiroshi Journal of the American Chemical Society, 1989 , vol. 111, # 6 p. 2361 - 2362 |
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~%
3-carboxy-2,3-d... CAS#:320-77-4
Learn More
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| Literature: Terasawa, Masato; Takahashi, Joji Agricultural and Biological Chemistry, 1981 , vol. 45, # 11 p. 2433 - 2442 |
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~%
3-carboxy-2,3-d... CAS#:320-77-4
Learn More
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| Literature: Terasawa, Masato; Takahashi, Joji Agricultural and Biological Chemistry, 1981 , vol. 45, # 11 p. 2433 - 2442 |
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~%
3-carboxy-2,3-d... CAS#:320-77-4 |
| Literature: Krebs; Holzach Biochemical Journal, 1952 , vol. 52, p. 527 Full Text View citing articles Show Details Friedrich-Freksa; Martius Zeitschrift fuer Naturforschung, 1951 , vol. 6b, p. 296 |
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~%
3-carboxy-2,3-d... CAS#:320-77-4
Detail
Learn More
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| Literature: Terasawa, Masato; Takahashi, Joji Agricultural and Biological Chemistry, 1981 , vol. 45, # 11 p. 2433 - 2442 |
|
~%
3-carboxy-2,3-d... CAS#:320-77-4
Learn More
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| Literature: Oogaki, Masako; Inoue, Madoka; Kaimaktchiev, Atanas C.; Nakahara, Tadaatsu; Tabuchi, Takeshi Agricultural and Biological Chemistry, 1984 , vol. 48, # 3 p. 789 - 796 |
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~%
3-carboxy-2,3-d... CAS#:320-77-4 |
| Literature: Greenstein Journal of Biological Chemistry, 1936 , vol. 116, p. 463,466 Full Text Show Details Pucher; Vickery Journal of Biological Chemistry, 1946 , vol. 163, p. 181 |
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~%
3-carboxy-2,3-d... CAS#:320-77-4 |
| Literature: Fittig; Miller Justus Liebigs Annalen der Chemie, 1889 , vol. 255, p. 43,46 |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: Displacement of 2OG from catalytic domain of PHD2 (181 to 426) (unknown origin) expre...
Source: ChEMBL
Target: Egl nine homolog 1
External Id: CHEMBL2318597
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Name: Displacement of 2OG from FIH (unknown origin) expressed in Escherichia coli at 400 uM
Source: ChEMBL
Target: N/A
External Id: CHEMBL2318596
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 1-hydroxypropane-1,2,3-tricarboxylic acid |
| 1-Hydroxy-propan-1,2,3-tricarbonsaeure |
| 1-hydroxy-propane-1,2,3-tricarboxylic acid |
| 3-Methylsaeure-pentanol-(2)-disaeure |
| I-CIT |
| D-isocitrate |
| isocitrate |
| 1-Hydroxytricarballylic acid |
| 1-Hydroxy-1,2,3-propanetricarboxylic acid |
| 3-Carboxy-2,3-dideoxy-1-hydroxypropan-1,2,3-tricarboxylic acid |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What are the uses of isocitric acid? |
| A: Main uses of isocitric acid: Isocitric acid is an endogenous metabolite present in Saliva and Cellular_Cytoplasm that can be used for the research of Alzheimer's Disease, Lewy Body Dementia and Anoxia[1][2][3]. |
| Q: What is the boiling point of isocitric acid? |
| A: Boiling point of isocitric acid is 329.6ºC at 760 mmHg. |
| Q: What is the InChIKey of isocitric acid? |
| A: InChIKey of isocitric acid is ODBLHEXUDAPZAU-UHFFFAOYSA-N. |
| Q: What is the SMILES notation of isocitric acid? |
| A: SMILES notation of isocitric acid is O=C(O)CC(C(=O)O)C(O)C(=O)O. |
| Q: What is the molecular weight of isocitric acid? |
| A: Molecular weight of isocitric acid is 192.12400. |
| Q: What English synonyms does isocitric acid have? |
| A: English synonyms of isocitric acid: 1-hydroxypropane-1,2,3-tricarboxylic acid, 1-Hydroxy-propan-1,2,3-tricarbonsaeure, 1-hydroxy-propane-1,2,3-tricarboxylic acid, 3-Methylsaeure-pentanol-(2)-disaeure, I-CIT, D-isocitrate, isocitrate, 1-Hydroxytricarballylic acid, 1-Hydroxy-1,2,3-propanetricarboxylic acid, 3-Carboxy-2,3-dideoxy-1-hydroxypropan-1,2,3-tricarboxylic acid. |
| Q: What is the polar surface area (PSA) of isocitric acid? |
| A: Polar surface area (PSA) of isocitric acid is 132.13000. |
| Q: What is the molecular formula of isocitric acid? |
| A: Molecular formula of isocitric acid is C6H8O7. |
| Q: What is the English name of isocitric acid? |
| A: The English name of isocitric acid is isocitric acid. |
| Q: What is the CAS number of isocitric acid? |
| A: CAS number of isocitric acid is 320-77-4. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| Dayang Chem (Hangzhou) Co., Ltd. |