acompound

Showing entry for 1-(3,4-Dimethoxyphenyl)ethanone

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0000220
Compound Name	1-(3,4-Dimethoxyphenyl)ethanone
Structure
Formula	C10H12O3
InchiKey	IQZLUWLMQNGTIW-UHFFFAOYSA-N
SMILES	COC1=C(OC)C=C(C=C1)C(C)=O
Inchi	InChI=1S/C10H12O3/c1-7(11)8-4-5-9(12-2)10(6-8)13-3/h4-6H,1-3H3
IUPAC	1-(3,4-dimethoxyphenyl)ethan-1-one
Molecular Weight	180.2
Pubchem Id	14328
Chembl Id	CHEMBL4218890

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

n.a

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

Binding DB

n.a

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

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
O42713	BXGT004563	Polyphenol oxidase 2	reviewed	-	PPO2	Inhibition	-	-	-

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00022	Oat	Avena sativa	Cereals and cereal products
BXGF00038	Tea	Camellia sinensis	Teas
BXGF03682	Imperata cylindrica	Imperata cylindrica	Medicinal Plant
BXGF03876	Vincetoxicum pycnostelma	Vincetoxicum pycnostelma	Others

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}