acompound

Showing entry for Peperomin E

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0025362
Compound Name	Peperomin E
Structure
Formula	C22H20O8
InchiKey	HSEIBOLBSKVJFP-CQSZACIVSA-N
SMILES	COc1cc(cc2c1OCO2)C([C@@H]1COC(=O)C1=C)c1cc(OC)c2c(c1)OCO2
Inchi	InChI=1S/C22H20O8/c1-11-14(8-26-22(11)23)19(12-4-15(24-2)20-17(6-12)27-9-29-20)13-5-16(25-3)21-18(7-13)28-10-30-21/h4-7,14,19H,1,8-10H2,2-3H3/t14-/m1/s1
IUPAC	(4S)-4-[bis(7-methoxy-1,3-benzodioxol-5-yl)methyl]-3-methylideneoxolan-2-one
Molecular Weight	412.12
Pubchem Id	10476763
Chembl Id	CHEMBL521941

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
O15111	BXGT004126	Inhibitor of nuclear factor kappa-B kinase subunit alpha	reviewed	Kinase	CHUK	Inhibition	-	-	-
P25963	BXGT009080	NF-kappa-B inhibitor alpha	reviewed	-	NFKBIA	Inhibition	-	-	-
O14920	BXGT004110	Inhibitor of nuclear factor kappa-B kinase subunit beta	reviewed	Kinase	IKBKB	Inhibition	-	-	-

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF01685	Metanarthecium luteoviride	Metanarthecium luteoviride	Others
BXGF02318	Pandanus tectorius	Pandanus tectorius	Medicinal Plant
BXGF04506	Sarcococca saligna	Sarcococca saligna	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}