Drug Information

Drug General Information
Drug ID
D0T5OD
Former ID
DNC003735
Drug Name
4-Sulfamoyloxy-benzoic acid cyclooctyl ester
Drug Type
Small molecular drug
Indication Discovery agent Investigative [526939]
Structure
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2D MOL

3D MOL
Formula
C15H21NO5S
Canonical SMILES
C1CCCC(CCC1)OC(=O)C2=CC=C(C=C2)OS(=O)(=O)N
InChI
1S/C15H21NO5S/c16-22(18,19)21-14-10-8-12(9-11-14)15(17)20-13-6-4-2-1-3-5-7-13/h8-11,13H,1-7H2,(H2,16,18,19)
InChIKey
AGVIMIWKQHZOFR-UHFFFAOYSA-N
PubChem Compound ID
10065009
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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