acompound

Showing entry for Butin

General Compound Information
BXGC Id	BXGC0000962
Compound Name	Butin
Structure
Formula	C15H12O5
InchiKey	MJBPUQUGJNAPAZ-AWEZNQCLSA-N
SMILES	OC1=CC2=C(C=C1)C(=O)C[C@H](O2)C1=CC=C(O)C(O)=C1
Inchi	InChI=1S/C15H12O5/c16-9-2-3-10-12(18)7-14(20-15(10)6-9)8-1-4-11(17)13(19)5-8/h1-6,14,16-17,19H,7H2/t14-/m0/s1
IUPAC	(2S)-2-(3,4-dihydroxyphenyl)-7-hydroxy-3,4-dihydro-2H-1-benzopyran-4-one
Molecular Weight	272.25
Pubchem Id	92775
Chembl Id	CHEMBL451168

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

50009647

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	BXGT007717	Aromatase	reviewed	Enzyme	CYP19A1	-	9600	-	-

CHEMBL

CHEMBL451168

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
P47199	BXGT010568	Quinone oxidoreductase	reviewed	-	Cryz	CD	'>'	10	ug ml-1
P11511	BXGT007717	Aromatase	reviewed	Enzyme	CYP19A1	IC50	'='	9600	nM
P11511	BXGT007717	Aromatase	reviewed	Enzyme	CYP19A1	Activity	'='	50	%
P11511	BXGT007717	Aromatase	reviewed	Enzyme	CYP19A1	Inhibition	-	-	-

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00106	Mango	Mangifera indica	Fruits
BXGF01286	Artemisia incanescens	Artemisia incanescens	Others
BXGF01332	Perriera orientalis	Perriera orientalis	Others
BXGF01652	Ichthyothere latifolia	Ichthyothere latifolia	Others
BXGF01676	Scrophularia umbrosa	Scrophularia umbrosa	Medicinal Plant
BXGF01742	Solanum sublobatum	Solanum sublobatum	Others
BXGF01830	Swertia pseudochinensis	Swertia pseudochinensis	Medicinal Plant
BXGF02626	Dalbergia odorifera	Dalbergia odorifera	Medicinal Plant
BXGF03546	Pseudofumaria lutea	Pseudofumaria lutea	Others
BXGF03973	Cyperus papyrus	Cyperus papyrus	Medicinal Plant
BXGF04033	Sabal blackburniana	Sabal blackburniana	Others
BXGF04263	Glycine soja	Glycine soja	Medicinal Plant
BXGF04301	Dorstenia dinklagei	Dorstenia dinklagei	Others
BXGF04302	Lachnophyllum gossypinum	Lachnophyllum gossypinum	Others
BXGF04328	Croton zehntneri	Croton zehntneri	Others
BXGF04451	Pteris cretica var. nervosa	Pteris cretica var. nervosa	Garden Plant
BXGF04772	Sapium haematospermum	Sapium haematospermum	Medicinal Plant
BXGF04965	Dimorphotheca aurantiaca	Dimorphotheca aurantiaca	Others
BXGF05367	Toxicodendron vernicifluum	Toxicodendron vernicifluum	Medicinal Plant
BXGF05452	Othonna dentata	Othonna dentata	Others
BXGF05583	Acacia mearnsii	Acacia mearnsii	Medicinal Plant
BXGF05684	Neorautanenia ficifolia	Neorautanenia ficifolia	Others
BXGF06064	Strychnos erichsonii	Strychnos erichsonii	Human Edible Plant
BXGF06131	Fagus grandifolia	Fagus grandifolia	Medicinal Plant
BXGF06204	Mitragyna inermis	Mitragyna inermis	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}