acompound

Showing entry for D-Epigalbacin

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0036201
Compound Name	D-Epigalbacin
Structure
Formula	C20H20O5
InchiKey	QFUXQRHAJWXPGP-YLYZPZNOSA-N
SMILES	C[C@@H]1[C@H](O[C@@H]([C@@H]1C)c1ccc2c(c1)OCO2)c1ccc2c(c1)OCO2
Inchi	InChI=1S/C20H20O5/c1-11-12(2)20(14-4-6-16-18(8-14)24-10-22-16)25-19(11)13-3-5-15-17(7-13)23-9-21-15/h3-8,11-12,19-20H,9-10H2,1-2H3/t11-,12+,19-,20-/m0/s1
IUPAC	5-[(2S,3R,4S,5S)-5-(1,3-benzodioxol-5-yl)-3,4-dimethyloxolan-2-yl]-1,3-benzodioxole
Molecular Weight	340.13
Pubchem Id	12310041
Chembl Id	CHEMBL2151191

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	BXGT013634	Mitogen-activated protein kinase 14	reviewed	Kinase	MAPK14	-	252000	-	-
reviewed	BXGT011494	Mitogen-activated protein kinase 1	reviewed		Mapk1	-	295000	-	-
reviewed	BXGT010495	Mitogen-activated protein kinase 9	reviewed	Kinase	MAPK9	-	2500	-	-
reviewed	BXGT010495	Mitogen-activated protein kinase 9	reviewed	Kinase	MAPK9	-	2200	-	-

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
P63086	BXGT011494	Mitogen-activated protein kinase 1	reviewed	-	Mapk1	IC50	'='	295000	nM
P45984	BXGT010495	Mitogen-activated protein kinase 9	reviewed	Kinase	MAPK9	IC50	'='	2200	nM
P45984	BXGT010495	Mitogen-activated protein kinase 9	reviewed	Kinase	MAPK9	Inhibition	'='	80	%
P05067	BXGT006306	Amyloid-beta precursor protein	reviewed	Enzyme modulator	APP	Activity	'='	59	%
P45984	BXGT010495	Mitogen-activated protein kinase 9	reviewed	Kinase	MAPK9	Inhibition	'='	82	%
P45984	BXGT010495	Mitogen-activated protein kinase 9	reviewed	Kinase	MAPK9	IC50	'='	2500	nM
P05067	BXGT006306	Amyloid-beta precursor protein	reviewed	Enzyme modulator	APP	Activity	'='	60	%
P45984	BXGT010495	Mitogen-activated protein kinase 9	reviewed	Kinase	MAPK9	Inhibition	-	-	-
P53779	BXGT011014	Mitogen-activated protein kinase 10	reviewed	Kinase	MAPK10	Inhibition	-	-	-
P45983	BXGT010494	Mitogen-activated protein kinase 8	reviewed	Kinase	MAPK8	Inhibition	-	-	-
P05067	BXGT006306	Amyloid-beta precursor protein	reviewed	Enzyme modulator	APP	Activity	'='	60	%
P05067	BXGT006306	Amyloid-beta precursor protein	reviewed	Enzyme modulator	APP	Activity	'='	60	%
Q16539	BXGT013634	Mitogen-activated protein kinase 14	reviewed	Kinase	MAPK14	IC50	'='	252000	nM
Q16539	BXGT013634	Mitogen-activated protein kinase 14	reviewed	Kinase	MAPK14	Inhibition	'='	50	%
P63086	BXGT011494	Mitogen-activated protein kinase 1	reviewed	-	Mapk1	Inhibition	'='	50	%

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF02988	Schisandra glaucescens	Schisandra glaucescens	Human Edible Plant
BXGF03056	Saururus chinensis	Saururus chinensis	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}