Drug General Information
Drug ID
D07KXK
Former ID
DNC006618
Drug Name
GALLOCATECHIN GALLATE
Drug Type
Small molecular drug
Indication Discovery agent Investigative [528213]
Structure
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2D MOL

3D MOL

Formula
C22H18O11
Canonical SMILES
C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C(=C3)O)O)O)OC(=O)C4<br />=CC(=C(C(=C4)O)O)O
InChI
1S/C22H18O11/c23-10-5-12(24)11-7-18(33-22(31)9-3-15(27)20(30)16(28)4-9)21(32-17(11)6-10)8-1-13(25)19(29)14(26)2-8/h1-6,18,21,23-30H,7H2/t18-,21+/m1/s1
InChIKey
WMBWREPUVVBILR-NQIIRXRSSA-N
PubChem Compound ID
Target and Pathway
Target(s) Fatty acid synthase Target Info Inhibitor [528213]
Beta-hydroxyacyl-acp dehydratase Target Info Inhibitor [528213]
Enoyl-ACP reductase Target Info Inhibitor [528213]
3-oxoacyl-[acyl-carrier protein] reductase Target Info Inhibitor [528213]
BioCyc Pathway Fatty acid biosynthesis initiation
Fatty acid elongation -- saturated
Palmitate biosynthesis
KEGG Pathway Fatty acid biosynthesis
Metabolic pathways
Fatty acid metabolism
AMPK signaling pathway
Insulin signaling pathwaypfa00061:Fatty acid biosynthesis
Biotin metabolism
Metabolic pathways
Fatty acid metabolism
Pathway Interaction Database p73 transcription factor network
Validated transcriptional targets of deltaNp63 isoforms
PathWhiz Pathway Fatty Acid Biosynthesis
Reactome ChREBP activates metabolic gene expression
Activation of gene expression by SREBF (SREBP)
Fatty Acyl-CoA Biosynthesis
WikiPathways Fatty Acid Biosynthesis
Nuclear Receptors Meta-Pathway
Liver X Receptor Pathway
Activation of Gene Expression by SREBP (SREBF)
SREBF and miR33 in cholesterol and lipid homeostasis
SREBP signalling
Metabolism of water-soluble vitamins and cofactors
Integration of energy metabolism
Fatty acid, triacylglycerol, and ketone body metabolism
AMPK Signaling
References
Ref 528213J Med Chem. 2006 Jun 1;49(11):3345-53.Inhibition of Plasmodium falciparum fatty acid biosynthesis: evaluation of FabG, FabZ, and FabI as drug targets for flavonoids.
Ref 528213J Med Chem. 2006 Jun 1;49(11):3345-53.Inhibition of Plasmodium falciparum fatty acid biosynthesis: evaluation of FabG, FabZ, and FabI as drug targets for flavonoids.

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