acompound

Showing entry for Medicagol

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0005752
Compound Name	Medicagol
Structure
Formula	C16H8O6
InchiKey	URMVEUAWRUQHON-UHFFFAOYSA-N
SMILES	OC1=CC2=C(C=C1)C1=C(C3=CC4=C(OCO4)C=C3O1)C(=O)O2
Inchi	InChI=1S/C16H8O6/c17-7-1-2-8-10(3-7)22-16(18)14-9-4-12-13(20-6-19-12)5-11(9)21-15(8)14/h1-5,17H,6H2
IUPAC	16-hydroxy-5,7,11,19-tetraoxapentacyclo[10.8.0.02,1?.0?,?.013,1?]icosa-1(12),2,4(8),9,13(18),14,16-heptaen-20-one
Molecular Weight	296.23
Pubchem Id	5319322
Chembl Id	CHEMBL99941

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
P06732	BXGT006489	Creatine kinase M-type	reviewed	Kinase	CKM	Concentration	'='	30	uM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00038	Tea	Camellia sinensis	Teas
BXGF00047	Chickpea	Cicer arietinum	Pulses
BXGF00264	Alfalfa	Medicago sativa	Herbs and Spices
BXGF00810	Cereals and cereal products		Cereals and cereal products
BXGF00818	Herbs and Spices		Herbs and Spices
BXGF00819	Pulses		Pulses
BXGF04062	Spatholobus suberectus	Spatholobus suberectus	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}