acompound

Showing entry for Futoenone

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0023185
Compound Name	Futoenone
Structure
Formula	C20H20O5
InchiKey	SXHVHWXETMBKPP-KXXATPMCSA-N
SMILES	COC1=C[C@@]23C[C@@H](OC2=CC1=O)C[C@@H]([C@H]3C)c1ccc2c(c1)OCO2
Inchi	InChI=1S/C20H20O5/c1-11-14(12-3-4-16-17(5-12)24-10-23-16)6-13-8-20(11)9-18(22-2)15(21)7-19(20)25-13/h3-5,7,9,11,13-14H,6,8,10H2,1-2H3/t11-,13+,14+,20-/m1/s1
IUPAC
Molecular Weight	340.13
Pubchem Id	9819306
Chembl Id	CHEMBL295191

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	BXGT006758	Stromelysin-1	reviewed	Enzyme	MMP3	-	<1000	-	-

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
P08254	BXGT006758	Stromelysin-1	reviewed	Enzyme	MMP3	Inhibition	'='	35	%
P08254	BXGT006758	Stromelysin-1	reviewed	Enzyme	MMP3	IC50	'<'	1000	nM
P14780	BXGT008053	Matrix metalloproteinase-9	reviewed	Enzyme	MMP9	Inhibition	'='	0	%
P03956	BXGT006120	Interstitial collagenase	reviewed	Enzyme	MMP1	Inhibition	'='	16	%

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF01958	Magnolia denudata	Magnolia denudata	Medicinal Plant
BXGF02004	Magnolia salicifolia	Magnolia salicifolia	Medicinal Plant
BXGF02759	Magnolia biondii	Magnolia biondii	Medicinal Plant
BXGF02843	Magnolia kobus	Magnolia kobus	Medicinal Plant
BXGF03977	Magnolia sprengeri	Magnolia sprengeri	Medicinal Plant
BXGF05353	Piper kadsura	Piper kadsura	Others
BXGF06144	Piper hancei	Piper hancei	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}