acompound

Showing entry for 2,4-Dihydroxyphenyl 2-(3,7-dimethyl-7-methoxy-2-octenyl)-3,4-dihydroxyphenethyl ketone

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0045650
Compound Name	2,4-Dihydroxyphenyl 2-(3,7-dimethyl-7-methoxy-2-octenyl)-3,4-dihydroxyphenethyl ketone
Structure
Formula	C26H34O6
InchiKey	JHLPMSFZJFPKFH-REZTVBANSA-N
SMILES	COC(CCC/C(=C/Cc1c(CCC(=O)c2ccc(cc2O)O)ccc(c1O)O)/C)(C)C
Inchi	InChI=1S/C26H34O6/c1-17(6-5-15-26(2,3)32-4)7-11-20-18(9-14-23(29)25(20)31)8-13-22(28)21-12-10-19(27)16-24(21)30/h7,9-10,12,14,16,27,29-31H,5-6,8,11,13,15H2,1-4H3/b17-7+
IUPAC
Molecular Weight	442.24
Pubchem Id	102193943
Chembl Id	CHEMBL3593937

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
P08151	BXGT006731	Zinc finger protein GLI1	reviewed	-	GLI1	Inhibition	-	-	-

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF05056	Artocarpus communis	Artocarpus communis	Others

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}