acompound

Showing entry for Broussonin C

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0048453
Compound Name	Broussonin C
Structure
Formula	C20H24O3
InchiKey	CMOZGCJOTGLPKO-UHFFFAOYSA-N
SMILES	CC(=CCc1cc(CCCc2ccc(cc2O)O)ccc1O)C
Inchi	InChI=1S/C20H24O3/c1-14(2)6-8-17-12-15(7-11-19(17)22)4-3-5-16-9-10-18(21)13-20(16)23/h6-7,9-13,21-23H,3-5,8H2,1-2H3
IUPAC	4-[3-[4-hydroxy-3-(3-methylbut-2-enyl)phenyl]propyl]benzene-1,3-diol
Molecular Weight	312.17
Pubchem Id	442289
Chembl Id	CHEMBL468906

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	BXGT004563	Polyphenol oxidase 2	reviewed		PPO2	-	430	-	-
reviewed	BXGT004563	Polyphenol oxidase 2	reviewed		PPO2	230	-	-	-
reviewed	BXGT004563	Polyphenol oxidase 2	reviewed		PPO2	-	570	-	-
reviewed	BXGT004563	Polyphenol oxidase 2	reviewed		PPO2	290	-	-	-
reviewed	BXGT004563	Polyphenol oxidase 2	reviewed		PPO2	48.5	-	-	-

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	Ki	'='	48	nM
O42713	BXGT004563	Polyphenol oxidase 2	reviewed	-	PPO2	Ki	'='	230	nM
O42713	BXGT004563	Polyphenol oxidase 2	reviewed	-	PPO2	IC50	'='	430	nM
O42713	BXGT004563	Polyphenol oxidase 2	reviewed	-	PPO2	Ki	'='	290	nM
O42713	BXGT004563	Polyphenol oxidase 2	reviewed	-	PPO2	IC50	'='	570	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF02193	Broussonetia kazinoki	Broussonetia kazinoki	Medicinal Plant
BXGF05476	Broussonetia papyrifera	Broussonetia papyrifera	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}