acompound

Showing entry for Notopterol

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0035962
Compound Name	Notopterol
Structure
Formula	C21H22O5
InchiKey	BKIACVAZUKISOR-MKMNVTDBSA-N
SMILES	C/C(=C\COc1c2ccoc2cc2c1ccc(=O)o2)/CC(C=C(C)C)O
Inchi	InChI=1S/C21H22O5/c1-13(2)10-15(22)11-14(3)6-8-25-21-16-4-5-20(23)26-19(16)12-18-17(21)7-9-24-18/h4-7,9-10,12,15,22H,8,11H2,1-3H3/b14-6+
IUPAC	4-[(2E)-5-hydroxy-3,7-dimethylocta-2,6-dienoxy]furo[3,2-g]chromen-7-one
Molecular Weight	354.15
Pubchem Id	5320227
Chembl Id	CHEMBL258939

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	BXGT009731	Mu-type opioid receptor	reviewed		Oprm1	>10000	-	-	-
reviewed	BXGT009618	Delta-type opioid receptor	reviewed		Oprd1	>10000	-	-	-
reviewed	BXGT010225	Kappa-type opioid receptor	reviewed	G-protein coupled receptor	OPRK1	>10000	-	-	-
reviewed	BXGT008440	D(1A) dopamine receptor	reviewed		Drd1	1422	-	-	-

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
P32300	BXGT009618	Delta-type opioid receptor	reviewed	-	Oprd1	Ki	'>'	10000	nM
P18901	BXGT008440	D(1A) dopamine receptor	reviewed	-	Drd1	Ki	'='	1422	nM
P18901	BXGT008440	D(1A) dopamine receptor	reviewed	-	Drd1	Activity	'>'	50	%
P33535	BXGT009731	Mu-type opioid receptor	reviewed	-	Oprm1	Ki	'>'	10000	nM
P41145	BXGT010225	Kappa-type opioid receptor	reviewed	G-protein coupled receptor	OPRK1	Ki	'>'	10000	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF03735	Hansenia weberbaueriana	Hansenia weberbaueriana	Others
BXGF03865	Hansenia forbesii	Hansenia forbesii	Others
BXGF04900	Ostericum grosseserratum	Ostericum grosseserratum	Human Edible 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}