Inosine,6-S-methyl-6-thio structure
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Common Name | Inosine,6-S-methyl-6-thio | ||
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| CAS Number | 342-69-8 | Molecular Weight | 298.32 | |
| Density | 1.85g/cm3 | Boiling Point | 636.3ºC at 760mmHg | |
| Molecular Formula | C11H14N4O4S | Melting Point | 166°C | |
| MSDS | Chinese USA | Flash Point | 338.6ºC | |
Use of Inosine,6-S-methyl-6-thio6-Methylmercaptopurine riboside is a purine nucleoside analog. Purine nucleoside analogs have broad antitumor activity targeting indolent lymphoid malignancies. Anticancer mechanisms in this process rely on inhibition of DNA synthesis, induction of apoptosis, etc[1]. |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 6-methylthioinosine |
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| Synonym | More Synonyms |
This table contains bioactivity, target information and biological‑assay experimental data of this compound.
| Description | 6-Methylmercaptopurine riboside is a purine nucleoside analog. Purine nucleoside analogs have broad antitumor activity targeting indolent lymphoid malignancies. Anticancer mechanisms in this process rely on inhibition of DNA synthesis, induction of apoptosis, etc[1]. |
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| Related Catalog | |
| References |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 1.85g/cm3 |
|---|---|
| Boiling Point | 636.3ºC at 760mmHg |
| Melting Point | 166°C |
| Molecular Formula | C11H14N4O4S |
| Molecular Weight | 298.32 |
| Flash Point | 338.6ºC |
| Exact Mass | 298.07400 |
| PSA | 138.82000 |
| Index of Refraction | 1.822 |
| InChIKey | ZDRFDHHANOYUTE-IOSLPCCCSA-N |
| SMILES | CSc1ncnc2c1ncn2C1OC(CO)C(O)C1O |
| Storage condition | −20°C |
| Stability | Incompatible with strong oxidizing agents. |
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
MUTATION 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 |
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| Safety Phrases | S22-S24/25 |
| RIDADR | NONH for all modes of transport |
| WGK Germany | 3 |
| RTECS | UO8985000 |
| HS Code | 29349990 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 9 | |
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| DownStream 9 | |
This table lists relevant public references with title, journal and publication metadata for this compound.
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The role of inosine-5'-monophosphate dehydrogenase in thiopurine metabolism in patients with inflammatory bowel disease.
Ther. Drug Monit. 33 , 200-208, (2011) There is a large interindividual variability in thiopurine metabolism. High concentrations of methylthioinosine-5'-monophosphate (meTIMP) and low concentrations of 6-thioguanine nucleotides (6-TGNs) h... |
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Methylthioadenosine deaminase in an alternative quorum sensing pathway in Pseudomonas aeruginosa.
Biochemistry 51(45) , 9094-103, (2012) Pseudomonas aeruginosa possesses an unusual pathway for 5'-methylthioadenosine (MTA) metabolism involving deamination to 5'-methylthioinosine (MTI) followed by N-ribosyl phosphorolysis to hypoxanthine... |
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A prospective, open-label trial of 6-thioguanine in patients with ulcerative or indeterminate colitis.
Scand. J. Gastroenterol. 40(10) , 1205-13, (2005) 6-thioguanine (6-TG) has emerged as a promising therapeutic alternative in patients with Crohn's disease intolerant or resistant to azathioprine (AZA) and/or 6-mercaptopurine (6-MP). The aim of the pr... |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: Concentration required to inhibit HSV type 1 strain HF induced cytopathogenic affects...
Source: ChEMBL
Target: Human alphaherpesvirus 1
External Id: CHEMBL694222
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Name: Virus rating against rhinovirus type 1A
Source: ChEMBL
Target: Human rhinovirus 1A
External Id: CHEMBL800916
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Name: Virus rating of against herpes simplex virus type 2
Source: ChEMBL
Target: Human alphaherpesvirus 2
External Id: CHEMBL696293
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Name: Antiviral activity against Zika virus PE243 infected in African green monkey Vero cel...
Source: ChEMBL
Target: Zika virus
External Id: CHEMBL4337947
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Name: In vitro antiviral activity in secondary cultures of rabbit kidney cells infected wit...
Source: ChEMBL
Target: Human alphaherpesvirus 1
External Id: CHEMBL877527
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Name: Virus rating against parainfluenza virus type 3
Source: ChEMBL
Target: Human respirovirus 3
External Id: CHEMBL762072
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Name: Inhibition Eimeria tenella growth
Source: ChEMBL
Target: Eimeria tenella
External Id: CHEMBL674773
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Name: Antiviral activity against SARS-CoV Frankfurt1 in Vero E6 cells by plaque reduction a...
Source: ChEMBL
Target: Severe acute respiratory syndrome-related coronavirus
External Id: CHEMBL887577
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Name: Inhibition of Cellular Replication of friend erythroleukemia cells
Source: ChEMBL
Target: Erythroleukemia cell line
External Id: CHEMBL681343
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Name: Virus rating against adenovirus type 2
Source: ChEMBL
Target: Human adenovirus 2
External Id: CHEMBL641423
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| EINECS 206-442-2 |
| 6-MethylmercaptopurineRiboside |
| MFCD00022826 |
| 6-Methylthioinosine |
| METHYLTHIOINOSINE |
| 6-Methylmercaptopurinribosid |
| 6-methylmp-riboside |
| 6-MMPR |
| 6-METHYLTHIOPURINE RIBOSIDE |
| 6-Methylmercaptopurine riboside |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the boiling point of 6-methylthioinosine? |
| A: Boiling point of 6-methylthioinosine is 636.3ºC at 760mmHg. |
| Q: What is the English name of 6-methylthioinosine? |
| A: The English name of 6-methylthioinosine is 6-methylthioinosine. |
| Q: What is the molecular formula of 6-methylthioinosine? |
| A: Molecular formula of 6-methylthioinosine is C11H14N4O4S. |
| Q: What is the SMILES notation of 6-methylthioinosine? |
| A: SMILES notation of 6-methylthioinosine is CSc1ncnc2c1ncn2C1OC(CO)C(O)C1O. |
| Q: What are the downstream products of 6-methylthioinosine? |
| A: Related downstream products(CAS) of 6-methylthioinosine: 50-66-8;18646-11-2;4338-47-0;58-61-7;23526-11-6;42021-78-3;132154-36-0;4542-23-8;53665-01-3. |
| Q: What are the uses of 6-methylthioinosine? |
| A: Main uses of 6-methylthioinosine: 6-Methylmercaptopurine riboside is a purine nucleoside analog. Purine nucleoside analogs have broad antitumor activity targeting indolent lymphoid malignancies. Anticancer mechanisms in this process rely on inhibition of DNA synthesis, induction of apoptosis, etc[1]. |
| Q: What is the CAS number of 6-methylthioinosine? |
| A: CAS number of 6-methylthioinosine is 342-69-8. |
| Q: What is the polar surface area (PSA) of 6-methylthioinosine? |
| A: Polar surface area (PSA) of 6-methylthioinosine is 138.82000. |
| Q: What is the melting point of 6-methylthioinosine? |
| A: Melting point of 6-methylthioinosine is 166°C. |
| Q: What is the molecular weight of 6-methylthioinosine? |
| A: Molecular weight of 6-methylthioinosine is 298.32. |
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. |