Drug Information

Drug General Information
Drug ID
D0T9BB
Former ID
DNC011331
Drug Name
7-methoxy-8-propionyl-2H-chromen-2-one
Drug Type
Small molecular drug
Indication Discovery agent Investigative [531259]
Formula
C13H12O4
Canonical SMILES
CCC(=O)C1=C(C=CC2=C1OC(=O)C=C2)OC
InChI
1S/C13H12O4/c1-3-9(14)12-10(16-2)6-4-8-5-7-11(15)17-13(8)12/h4-7H,3H2,1-2H3
InChIKey
XQJPTVQKFUWDCL-UHFFFAOYSA-N
PubChem Compound ID
52950111
Target and Pathway
Target(s) Carbonic anhydrase IX Target Info Inhibitor [531259]
KEGG Pathway Nitrogen metabolism
Pathway Interaction Database HIF-1-alpha transcription factor network
Reactome Regulation of gene expression by Hypoxia-inducible Factor
Reversible hydration of carbon dioxide
WikiPathways Vitamin D Receptor Pathway
Reversible Hydration of Carbon Dioxide
Regulation of Hypoxia-inducible Factor (HIF) by Oxygen
References
Ref 531259Bioorg Med Chem Lett. 2010 Dec 15;20(24):7255-8. Epub 2010 Oct 25.7,8-disubstituted- but not 6,7-disubstituted coumarins selectively inhibit the transmembrane, tumor-associated carbonic anhydrase isoforms IX and XII over the cytosolic ones I and II in the low nanomolar/subnanomolar range.
Ref 531259Bioorg Med Chem Lett. 2010 Dec 15;20(24):7255-8. Epub 2010 Oct 25.7,8-disubstituted- but not 6,7-disubstituted coumarins selectively inhibit the transmembrane, tumor-associated carbonic anhydrase isoforms IX and XII over the cytosolic ones I and II in the low nanomolar/subnanomolar range.

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