Drug Information

Drug General Information
Drug ID
D0O1ZM
Former ID
DNC004636
Drug Name
3-(4-Amino-phenyl)-3-hexyl-piperidine-2,6-dione
Drug Type
Small molecular drug
Indication Discovery agent Investigative [533478]
Structure
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2D MOL

3D MOL
Formula
C17H24N2O2
Canonical SMILES
CCCCCCC1(CCC(=O)NC1=O)C2=CC=C(C=C2)N
InChI
1S/C17H24N2O2/c1-2-3-4-5-11-17(12-10-15(20)19-16(17)21)13-6-8-14(18)9-7-13/h6-9H,2-5,10-12,18H2,1H3,(H,19,20,21)
InChIKey
VWJXCBZWAWHJLE-UHFFFAOYSA-N
PubChem Compound ID
13660225
Target and Pathway
Target(s) Cytochrome P450 19 Target Info Inhibitor [533478]
BioCyc Pathway Superpathway of steroid hormone biosynthesis
Estradiol biosynthesis II
Estradiol biosynthesis I
KEGG Pathway Steroid hormone biosynthesis
Metabolic pathways
Ovarian steroidogenesis
NetPath Pathway FSH Signaling Pathway
PANTHER Pathway Androgen/estrogene/progesterone biosynthesis
PathWhiz Pathway Androgen and Estrogen Metabolism
Reactome Endogenous sterols
WikiPathways Metapathway biotransformation
Tryptophan metabolism
Oxidation by Cytochrome P450
Ovarian Infertility Genes
Metabolism of steroid hormones and vitamin D
FSH signaling pathway
Integrated Breast Cancer Pathway
Phase 1 - Functionalization of compounds
References
Ref 533478J Med Chem. 1986 Aug;29(8):1362-9.Aromatase inhibitors. Synthesis and evaluation of mammary tumor inhibiting activity of 3-alkylated 3-(4-aminophenyl)piperidine-2,6-diones.
Ref 533478J Med Chem. 1986 Aug;29(8):1362-9.Aromatase inhibitors. Synthesis and evaluation of mammary tumor inhibiting activity of 3-alkylated 3-(4-aminophenyl)piperidine-2,6-diones.

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