acompound

Showing entry for Arbutin

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0000761
Compound Name	Arbutin
Structure
Formula	C12H16O7
InchiKey	BJRNKVDFDLYUGJ-UHFFFAOYSA-N
SMILES	OCC1OC(OC2=CC=C(O)C=C2)C(O)C(O)C1O
Inchi	InChI=1S/C12H16O7/c13-5-8-9(15)10(16)11(17)12(19-8)18-7-3-1-6(14)2-4-7/h1-4,8-17H,5H2
IUPAC	2-(hydroxymethyl)-6-(4-hydroxyphenoxy)oxane-3,4,5-triol
Molecular Weight	272.25
Pubchem Id	346
Chembl Id	CHEMBL79041

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

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	BXGT007687	Tyrosinase	reviewed		Tyr	-	624600	-	-
reviewed	BXGT004563	Polyphenol oxidase 2	reviewed		PPO2	-	295700	-	-

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

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00069	Quince	Cydonia oblonga	Fruits
BXGF00122	Sweet marjoram	Origanum majorana	Herbs and Spices
BXGF00152	Pear	Pyrus communis	Fruits
BXGF00193	Bilberry	Vaccinium myrtillus	Fruits
BXGF00194	Lingonberry	Vaccinium vitis-idaea	Fruits
BXGF00808	Pomes		Fruits

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}