Drug Information
| Drug General Information | Top | |||
|---|---|---|---|---|
| Drug ID |
D07DGS
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| Former ID |
DNC007108
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| Drug Name |
NSC-2113
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| Synonyms |
1,4-Diethoxybenzene; 122-95-2; Benzene, 1,4-diethoxy-; p-Diethoxybenzene; Hydroquinone diethyl ether; Benzene, p-diethoxy-; NSC-2113; 1,4-diethoxy-benzen; UNII-C6Y51501JB; CHEMBL219898; VWGNFIQXBYRDCH-UHFFFAOYSA-N; C6Y51501JB; Benzene,4-diethoxy-; NSC2113; NSC 2113; EINECS 204-585-5; 1,4-diethoxybenzol; hydroquinonedlethylether; ACMC-209ans; AI3-09458; AC1Q37UB; AC1L26YB; KSC174M8J; SCHEMBL124015; Benzene, p-diethoxy- (8CI); Jsp001542; DTXSID9059549; CTK0H4684; KS-00000WIN; MolPort-001-759-994; ZINC394919; NSC68808; SBB060362
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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 |
C10H14O2
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| Canonical SMILES |
CCOC1=CC=C(C=C1)OCC
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| InChI |
1S/C10H14O2/c1-3-11-9-5-7-10(8-6-9)12-4-2/h5-8H,3-4H2,1-2H3
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| InChIKey |
VWGNFIQXBYRDCH-UHFFFAOYSA-N
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| CAS Number |
CAS 122-95-2
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| PubChem Compound ID | ||||
| Target and Pathway | Top | |||
|---|---|---|---|---|
| Target(s) | Quinone reductase 1 (NQO1) | Target Info | Inhibitor | [1] |
| KEGG Pathway | Ubiquinone and other terpenoid-quinone biosynthesis | |||
| NetPath Pathway | TCR Signaling Pathway | |||
| Pathwhiz Pathway | Vitamin K Metabolism | |||
| Pathway Interaction Database | Validated transcriptional targets of TAp63 isoforms | |||
| WikiPathways | Estrogen metabolism | |||
| Oxidative Stress | ||||
| Transcriptional activation by NRF2 | ||||
| NRF2 pathway | ||||
| Nuclear Receptors Meta-Pathway | ||||
| Aryl Hydrocarbon Receptor Pathway | ||||
| Apoptosis-related network due to altered Notch3 in ovarian cancer | ||||
| Metabolism of amino acids and derivatives | ||||
| Aryl Hydrocarbon Receptor | ||||
| Dopamine metabolism | ||||
| Arylhydrocarbon receptor (AhR) signaling pathway | ||||
| References | Top | |||
|---|---|---|---|---|
| REF 1 | In silico identification and biochemical characterization of novel inhibitors of NQO1. Bioorg Med Chem Lett. 2006 Dec 15;16(24):6246-54. | |||
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