acompound

Showing entry for 3-Ethyl-2,5-Dihydroxycyclohexa-2,5-Diene-1,4-Dione

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0017483
Compound Name	3-Ethyl-2,5-Dihydroxycyclohexa-2,5-Diene-1,4-Dione
Structure
Formula	C8H8O4
InchiKey	WJSQCAWGGRFZJK-UHFFFAOYSA-N
SMILES	CCC1=C(O)C(=O)C=C(C1=O)O
Inchi	InChI=1S/C8H8O4/c1-2-4-7(11)5(9)3-6(10)8(4)12/h3,9,12H,2H2,1H3
IUPAC	3-ethyl-2,5-dihydroxycyclohexa-2,5-diene-1,4-dione
Molecular Weight	168.04
Pubchem Id	821411
Chembl Id	CHEMBL222173

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
P98170	BXGT012231	E3 ubiquitin-protein ligase XIAP	reviewed	Enzyme modulator	XIAP	Ki	'='	10400	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF01866	Heliotropium indicum	Heliotropium indicum	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}