acompound

Showing entry for (R)-Shinanolone

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0001784
Compound Name	(R)-Shinanolone
Structure
Formula	C11H12O3
InchiKey	JOCZVRFSKAUXRP-UHFFFAOYSA-N
SMILES	CC1=CC2=C(C(=O)CCC2O)C(O)=C1
Inchi	InChI=1S/C11H12O3/c1-6-4-7-8(12)2-3-9(13)11(7)10(14)5-6/h4-5,8,12,14H,2-3H2,1H3
IUPAC	4,8-dihydroxy-6-methyl-1,2,3,4-tetrahydronaphthalen-1-one
Molecular Weight	192.21
Pubchem Id	12315505
Chembl Id	CHEMBL3884255

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
P9WG47	BXGT012264	DNA gyrase subunit A	reviewed	-	gyrA	IC50	'>'	200000	nM
P9WG45	BXGT012263	DNA gyrase subunit B	reviewed	-	gyrB	IC50	'>'	200000	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00823	Fruits		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}