acompound

Showing entry for pyrogallol 1,3-dimethyl ether

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0041351
Compound Name	pyrogallol 1,3-dimethyl ether
Structure
Formula	C8H10O3
InchiKey	KLIDCXVFHGNTTM-UHFFFAOYSA-N
SMILES	COc1cccc(c1O)OC
Inchi	InChI=1S/C8H10O3/c1-10-6-4-3-5-7(11-2)8(6)9/h3-5,9H,1-2H3
IUPAC	2,6-dimethoxyphenol
Molecular Weight	154.06
Pubchem Id	7041
Chembl Id	CHEMBL109652

Targets of Information Source

DrugBank

n.a

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Groups	Target Type
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Groups	Target Type

PDB

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	Ka M-1
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	Ka M-1
Q70KY3	BXGT016676	Laccase-1	reviewed	LAC1	-	-	-	-	-
Q8WZK8	BXGT019026	DyP	unreviewed	dyp	-	-	-	-	-
A0A076MY51	BXGT000069	Cytochrome P450	unreviewed	AMETH_3834	-	-	-	-	-
B9W4V6	BXGT002359	Aromatic peroxygenase	reviewed	APO1	-	-	-	-	-
P0DPQ7	BXGT024215	Aromatic O-demethylase, cytochrome P450 subunit	reviewed	gcoA	-	-	-	1700	-
P0DPQ7	BXGT024215	Aromatic O-demethylase, cytochrome P450 subunit	reviewed	gcoA	-	-	-	-	-

Binding DB

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	EC50 nM
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	EC50 nM
reviewed	BXGT008061	Gamma-aminobutyric acid receptor subunit alpha-1	reviewed	Ion channel	GABRA1	-	-	-	100000000

CHEMBL

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	width="10%">Type	Relation	value	Units
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Type	Relation	value	Units
P18507	BXGT008411	Gamma-aminobutyric acid receptor subunit gamma-2	reviewed	Ion channel	GABRG2	EC50	'='	100000000	nM
P47870	BXGT010591	Gamma-aminobutyric acid receptor subunit beta-2	reviewed	Ion channel	GABRB2	EC50	'='	100000000	nM
P14867	BXGT008061	Gamma-aminobutyric acid receptor subunit alpha-1	reviewed	Ion channel	GABRA1	EC50	'='	100000000	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF01954	Amomum tsao-ko	Amomum tsao-ko	Human Edible Plant
BXGF03610	Bistorta officinalis	Bistorta officinalis	Medicinal Plant
BXGF03766	Drynaria fortunei	Drynaria fortunei	Medicinal Plant
BXGF04062	Spatholobus suberectus	Spatholobus suberectus	Medicinal Plant
BXGF04224	Bistorta manshuriensis	Bistorta manshuriensis	Others
BXGF04534	Panax japonicus	Panax japonicus	Medicinal Plant
BXGF04712	Prunus mume	Prunus mume	Medicinal Plant

The compound-realted diseases

Diseases

BXGD Id	Disease Name	CUI Disease Id	Disease Class Name	Number of targets^{?Number of targets related to compound connecting disease, higher numbers indicate the compound is more associated with the disease}