Drug General Information
Drug ID
D0I6SI
Former ID
DNC013154
Drug Name
3-hydroxy-2-propionylcyclohex-2-enone
Drug Type
Small molecular drug
Indication Discovery agent Investigative [528436]
Structure
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2D MOL

3D MOL

Formula
C9H12O3
Canonical SMILES
CCC(=C1C(=O)CCCC1=O)O
InChI
1S/C9H12O3/c1-2-6(10)9-7(11)4-3-5-8(9)12/h10H,2-5H2,1H3
InChIKey
KIXYWPAKWURPPK-UHFFFAOYSA-N
PubChem Compound ID
Target and Pathway
Target(s) 4-hydroxyphenylpyruvate dioxygenase Target Info Inhibitor [528436]
KEGG Pathway Ubiquinone and other terpenoid-quinone biosynthesis
Tyrosine metabolism
Phenylalanine metabolism
Metabolic pathways
References
Ref 528436Bioorg Med Chem Lett. 2006 Dec 1;16(23):6024-7. Epub 2006 Sep 18.Enzyme inhibition potency enhancement by active site metal chelating and hydrogen bonding induced conformation-restricted cyclopropanecarbonyl derivatives.
Ref 528436Bioorg Med Chem Lett. 2006 Dec 1;16(23):6024-7. Epub 2006 Sep 18.Enzyme inhibition potency enhancement by active site metal chelating and hydrogen bonding induced conformation-restricted cyclopropanecarbonyl derivatives.

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