acompound

Showing entry for Dihydroguaiaretic Acid

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0021306
Compound Name	Dihydroguaiaretic Acid
Structure
Formula	C20H26O4
InchiKey	ADFOLUXMYYCTRR-UHFFFAOYSA-N
SMILES	COc1cc(ccc1O)CC(C(Cc1ccc(c(c1)OC)O)C)C
Inchi	InChI=1S/C20H26O4/c1-13(9-15-5-7-17(21)19(11-15)23-3)14(2)10-16-6-8-18(22)20(12-16)24-4/h5-8,11-14,21-22H,9-10H2,1-4H3
IUPAC	4-[4-(4-hydroxy-3-methoxyphenyl)-2,3-dimethylbutyl]-2-methoxyphenol
Molecular Weight	330.18
Pubchem Id	161924
Chembl Id	CHEMBL1976696

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	BXGT005953	Transthyretin	reviewed	Transporter	TTR	-	-	-	6300

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
P02766	BXGT005953	Transthyretin	reviewed	Transporter	TTR	Activity	-	-	-
P02766	BXGT005953	Transthyretin	reviewed	Transporter	TTR	EC50	'='	6300	nM
P01100	BXGT005727	Proto-oncogene c-Fos	reviewed	Transcription factor	FOS	IC50	'='	210	nM
P05412	BXGT006354	Transcription factor AP-1	reviewed	Transcription factor	JUN	IC50	'='	210	nM
P02766	BXGT005953	Transthyretin	reviewed	Transporter	TTR	Inhibition	'<'	20	%

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
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}