Drug Information
| Drug General Information | Top | |||
|---|---|---|---|---|
| Drug ID |
D0LU4S
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| Former ID |
DNC010063
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| Drug Name |
7-butoxy-2H-chromen-2-one
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| Synonyms |
7-butoxy-2H-chromen-2-one; 7-BUTOXYCOUMARIN; 7-butoxychromen-2-one; 2H-1-Benzopyran-2-one, 7-butoxy-; CHEMBL571514; 71783-00-1; CBMicro_045472; AC1L4FS0; SCHEMBL6686295; DTXSID40221994; MolPort-002-085-798; ZINC2950199; STK371317; BDBM50303502; AKOS001064182; MCULE-1530014848; BIM-0045671.P001; ST50462808; SR-01000227430
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| Drug Type |
Small molecular drug
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| Indication | Discovery agent [ICD-11: N.A.] | Investigative | [1] | |
| Structure |
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Download2D MOL |
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| Formula |
C13H14O3
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| Canonical SMILES |
CCCCOC1=CC2=C(C=C1)C=CC(=O)O2
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| InChI |
1S/C13H14O3/c1-2-3-8-15-11-6-4-10-5-7-13(14)16-12(10)9-11/h4-7,9H,2-3,8H2,1H3
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| InChIKey |
BDOGTORASJEUBW-UHFFFAOYSA-N
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| CAS Number |
CAS 71783-00-1
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| PubChem Compound ID | ||||
| Target and Pathway | Top | |||
|---|---|---|---|---|
| Target(s) | Carbonic anhydrase (CA) | Target Info | Inhibitor | [1] |
| Carbonic anhydrase IX (CA-IX) | Target Info | Inhibitor | [1] | |
| Carbonic anhydrase VI (CA-VI) | Target Info | Inhibitor | [1] | |
| Carbonic anhydrase XII (CA-XII) | Target Info | Inhibitor | [1] | |
| Carbonic anhydrase XIV (CA-XIV) | Target Info | Inhibitor | [1] | |
| KEGG Pathway | Nitrogen metabolism | |||
| NetPath Pathway | TGF_beta_Receptor Signaling Pathway | |||
| Pathway Interaction Database | HIF-1-alpha transcription factor network | |||
| Reactome | Reversible hydration of carbon dioxide | |||
| Regulation of gene expression by Hypoxia-inducible Factor | ||||
| WikiPathways | Reversible Hydration of Carbon Dioxide | |||
| Vitamin D Receptor Pathway | ||||
| Regulation of Hypoxia-inducible Factor (HIF) by Oxygen | ||||
| miR-targeted genes in muscle cell - TarBase | ||||
| miR-targeted genes in leukocytes - TarBase | ||||
| miR-targeted genes in epithelium - TarBase | ||||
| References | Top | |||
|---|---|---|---|---|
| REF 1 | Deciphering the mechanism of carbonic anhydrase inhibition with coumarins and thiocoumarins. J Med Chem. 2010 Jan 14;53(1):335-44. | |||
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