Drug Information

Drug General Information
Drug ID
D0D1CV
Former ID
DNC003730
Drug Name
4-Sulfamoyloxy-benzoic acid hexyl ester
Drug Type
Small molecular drug
Indication Discovery agent Investigative [526939]
Structure
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2D MOL

3D MOL
Formula
C13H19NO5S
Canonical SMILES
CCCCCCOC(=O)C1=CC=C(C=C1)OS(=O)(=O)N
InChI
1S/C13H19NO5S/c1-2-3-4-5-10-18-13(15)11-6-8-12(9-7-11)19-20(14,16)17/h6-9H,2-5,10H2,1H3,(H2,14,16,17)
InChIKey
PJIPMHPXRQOHKO-UHFFFAOYSA-N
PubChem Compound ID
9879424
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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