Drug Information

Drug General Information
Drug ID
D06YDQ
Former ID
DNC003752
Drug Name
4-Sulfamoyloxy-benzoic acid heptyl ester
Drug Type
Small molecular drug
Indication Discovery agent Investigative [526939]
Structure
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2D MOL

3D MOL
Formula
C14H21NO5S
Canonical SMILES
CCCCCCCOC(=O)C1=CC=C(C=C1)OS(=O)(=O)N
InChI
1S/C14H21NO5S/c1-2-3-4-5-6-11-19-14(16)12-7-9-13(10-8-12)20-21(15,17)18/h7-10H,2-6,11H2,1H3,(H2,15,17,18)
InChIKey
XTVXDGYXZNQKRA-UHFFFAOYSA-N
PubChem Compound ID
9796948
Target and Pathway
Target(s) Steryl-sulfatase Target Info Inhibitor [526939]
KEGG Pathway Steroid hormone biosynthesis
PathWhiz Pathway Androgen and Estrogen Metabolism
Reactome Glycosphingolipid metabolism
WikiPathways Estrogen metabolism
Vitamin D Receptor Pathway
Sphingolipid metabolism
References
Ref 526939Bioorg Med Chem Lett. 2004 Feb 9;14(3):605-9.Inhibition of estrone sulfatase (ES) by alkyl and cycloalkyl ester derivatives of 4-[(aminosulfonyl)oxy] benzoic acid.
Ref 526939Bioorg Med Chem Lett. 2004 Feb 9;14(3):605-9.Inhibition of estrone sulfatase (ES) by alkyl and cycloalkyl ester derivatives of 4-[(aminosulfonyl)oxy] benzoic acid.

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