Drug Information
| Drug General Information | Top | |||
|---|---|---|---|---|
| Drug ID |
D0YQ0G
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| Former ID |
DNC000047
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| Drug Name |
2,4,6 trinitrobenzene sulfonate 1,3-bis (2-chlorethyl)-1-nitrosourea
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| Drug Type |
Small molecular drug
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| Indication | Discovery agent [ICD-11: N.A.] | Investigative | [1] | |
| Structure |
 |
Download2D MOL |
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| Formula |
C11H12Cl2N6O11S
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| Canonical SMILES |
C1=C(C=C(C(=C1[N+](=O)[O-])S(=O)(=O)[O-])[N+](=O)[O-])[N+](=O)[O-].C(CCl)[NH2+]C(=O)N(CCCl)N=O
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| InChI |
1S/C6H3N3O9S.C5H9Cl2N3O2/c10-7(11)3-1-4(8(12)13)6(19(16,17)18)5(2-3)9(14)15;6-1-3-8-5(11)10(9-12)4-2-7/h1-2H,(H,16,17,18);1-4H2,(H,8,11)
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| InChIKey |
LMBKFJAIRIBNHB-UHFFFAOYSA-N
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| PubChem Compound ID | ||||
| PubChem Substance ID | ||||
| Target and Pathway | Top | |||
|---|---|---|---|---|
| Target(s) | Glutathione reductase (GR) | Target Info | Inhibitor | [1] |
| BioCyc | Glutathione redox reactions II | |||
| Glutathione redox reactions I | ||||
| KEGG Pathway | Glutathione metabolism | |||
| Thyroid hormone synthesis | ||||
| Pathwhiz Pathway | Glutamate Metabolism | |||
| Glutathione Metabolism | ||||
| WikiPathways | Metapathway biotransformation | |||
| Sulfation Biotransformation Reaction | ||||
| Oxidative Stress | ||||
| NRF2 pathway | ||||
| Nuclear Receptors Meta-Pathway | ||||
| Selenium Micronutrient Network | ||||
| Glutathione metabolism | ||||
| References | Top | |||
|---|---|---|---|---|
| REF 1 | The purification and properties of glutathione reductase from the cestode Moniezia expansa. Int J Biochem Cell Biol. 1995 Apr;27(4):393-401. | |||
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