Cocarboxylase
Cocarboxylase structure
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Common Name | Cocarboxylase | ||
|---|---|---|---|---|
| CAS Number | 154-87-0 | Molecular Weight | 460.767 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C12H19ClN4O7P2S | Melting Point | N/A | |
| MSDS | USA | Flash Point | N/A | |
Use of CocarboxylaseThiamine pyrophosphate is the coenzyme form of Vitamin B1 and is a required intermediate in the pyruvate dehydrogenase complex and the ketoglutarate dehydrogenase complex. |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | thiamine(1+) diphosphate |
|---|---|
| Synonym | More Synonyms |
This table contains bioactivity, target information and biological‑assay experimental data of this compound.
| Description | Thiamine pyrophosphate is the coenzyme form of Vitamin B1 and is a required intermediate in the pyruvate dehydrogenase complex and the ketoglutarate dehydrogenase complex. |
|---|---|
| Related Catalog | |
| Target |
Human Endogenous Metabolite |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Molecular Formula | C12H19ClN4O7P2S |
|---|---|
| Molecular Weight | 460.767 |
| Exact Mass | 460.013824 |
| PSA | 216.83000 |
| InChIKey | YXVCLPJQTZXJLH-UHFFFAOYSA-N |
| SMILES | Cc1ncc(C[n+]2csc(CCOP(=O)(O)OP(=O)(O)O)c2C)c(N)n1.[Cl-] |
| Storage condition | 2-8°C |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
This table summarizes toxicological test data, acute & chronic toxicity and ecological hazard parameters for this chemical.
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATAACUTE TOXICITY DATA
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This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Personal Protective Equipment | Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter |
|---|---|
| Risk Phrases | R22 |
| Safety Phrases | S22-S24/25 |
| RIDADR | 1759 |
| WGK Germany | 3 |
| RTECS | XI7552000 |
| Packaging Group | III |
| Hazard Class | 8 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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Cocarboxylase CAS#:154-87-0
Learn More
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| Literature: Justus Liebigs Annalen der Chemie, , vol. 618, p. 210,215, 219 Yakugaku Zasshi, , vol. 76, p. 1314,1317 Chem.Abstr., , p. 3607 Helvetica Chimica Acta, , vol. 32, p. 1478,1483 Journal of Vitaminology, , vol. 5, p. 44,49 |
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Cocarboxylase CAS#:154-87-0 |
| Literature: Chemische Berichte, , vol. 95, p. 767 - 772 |
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Cocarboxylase CAS#:154-87-0 |
| Literature: Chemische Berichte, , vol. 95, p. 767 - 772 |
![3-[(4-Amino-2-methyl-5-pyrimidinyl)methyl]-4-methyl-5-[2-(phosphonooxy)ethyl]thiazolium structure](https://image.chemsrc.com/caspic/330/10023-48-0.png)
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 3 | |
|---|---|
| DownStream 1 | |
CAS#:532-40-1This table lists relevant public references with title, journal and publication metadata for this compound.
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Regulation at multiple levels control the expression of folate transporters in liver cells in conditions of ethanol exposure and folate deficiency.
Biofactors 41 , 232-41, (2015) Complex regulatory mechanisms control the expression of folate transporters within cells. Liver is the primary reserve of the folate stores within the body. As excessive alcohol consumption or ineffic... |
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The Janus kinase 2 inhibitor fedratinib inhibits thiamine uptake: a putative mechanism for the onset of Wernicke's encephalopathy.
Drug Metab. Dispos. 42(10) , 1656-62, (2014) The clinical development of fedratinib, a Janus kinase (JAK2) inhibitor, was terminated after reports of Wernicke's encephalopathy in myelofibrosis patients. Since Wernicke's encephalopathy is induced... |
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Gene Transfer Efficiency in Gonococcal Biofilms: Role of Biofilm Age, Architecture, and Pilin Antigenic Variation.
J. Bacteriol. 197 , 2422-31, (2015) Extracellular DNA is an important structural component of many bacterial biofilms. It is unknown, however, to which extent external DNA is used to transfer genes by means of transformation. Here, we q... |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 3-[(4-Amino-2-methylpyrimidin-5-yl)methyl]-5-(2-{[hydroxy(phosphonooxy)phosphoryl]oxy}ethyl)-4-methyl-1,3-thiazol-3-ium chloride |
| TDP |
| Vitamin B1 Pyrophosphoric Acid Ester Chloride |
| 3-[(4-Amino-2-methyl-5-pyrimidinyl)methyl]-5-[2-[[hydroxy(phosphonooxy)phosphinyl]oxy]ethyl]-4-methylthiazolium Chloride |
| 3-[(4-Amino-2-methyl-5-pyrimidinyl)methyl]-5-(2-{[hydroxy(phosphonooxy)phosphoryl]oxy}ethyl)-4-methyl-1,3-thiazol-3-ium chloride |
| Cocarboxylase |
| MFCD00038740 |
| 3-[(4-Amino-2-methyl-5-pyrimidinyl)methyl]-4-methyl-5-(4,6,6-trihydroxy-3,5-dioxa-4,6-diphosphahex-1-yl)thiazolium Chloride P,P'-Dioxide |
| cocarboxylasum [INN_la] |
| Vitamin B1 Pyrophosphate Chloride |
| Thiamine pyrophosphate |
| Aneurinepyrophosphoric acid Cocarboxylase Thiamine pyrophosphate chloride |
| 3-[(4-Amino-2-methyl-5-pyrimidinyl)methyl]-4-methyl-5-(4,6,6-trihydroxy-4,6-dioxido-3,5-dioxa-4,6-diphosphahex-1-yl)thiazolium Chloride |
| Co-B1 |
| tpp |
| EINECS 205-230-7 |
| Bioxilasi |
| thiazolium, 3-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-5-[2-[[hydroxy(phosphonooxy)phosphinyl]oxy]ethyl]-4-methyl-, chloride (1:1) |
| TPP (VAN) |
| Thiamine Pyrophosphoric Acid Ester Chloride |
| Thiamine Pyrophosphate Chloride |
| thiamine(1+) diphosphate chloride |
| Thiamine Diphosphate Ester Chloride |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the molecular weight of thiamine(1+) diphosphate? |
| A: Molecular weight of thiamine(1+) diphosphate is 460.767. |
| Q: What is the SMILES notation of thiamine(1+) diphosphate? |
| A: SMILES notation of thiamine(1+) diphosphate is Cc1ncc(C[n+]2csc(CCOP(=O)(O)OP(=O)(O)O)c2C)c(N)n1.[Cl-]. |
| Q: What are the uses of thiamine(1+) diphosphate? |
| A: Main uses of thiamine(1+) diphosphate: Thiamine pyrophosphate is the coenzyme form of Vitamin B1 and is a required intermediate in the pyruvate dehydrogenase complex and the ketoglutarate dehydrogenase complex. |
| Q: What is the molecular formula of thiamine(1+) diphosphate? |
| A: Molecular formula of thiamine(1+) diphosphate is C12H19ClN4O7P2S. |
| Q: What is the CAS number of thiamine(1+) diphosphate? |
| A: CAS number of thiamine(1+) diphosphate is 154-87-0. |
| Q: What is the polar surface area (PSA) of thiamine(1+) diphosphate? |
| A: Polar surface area (PSA) of thiamine(1+) diphosphate is 216.83000. |
| Q: What are the upstream materials of thiamine(1+) diphosphate? |
| A: Related upstream materials(CAS) of thiamine(1+) diphosphate: 50851-39-3;67-03-8;2908-71-6. |
| Q: What is the safety information for thiamine(1+) diphosphate? |
| A: Safety information for thiamine(1+) diphosphate: S22-S24/25. |
| Q: What are the storage conditions for thiamine(1+) diphosphate? |
| A: Storage conditions for thiamine(1+) diphosphate: 2-8°C. |
| Q: What are the downstream products of thiamine(1+) diphosphate? |
| A: Related downstream products(CAS) of thiamine(1+) diphosphate: 532-40-1. |
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. |
| Henan Tianfu Chemical Co., Ltd. |