acompound

Showing entry for (2R)-2alpha-(4-Hydroxyphenyl)-3beta,5,6,7-tetrahydroxy-3,4-dihydro-2H-1-benzopyran-4-one

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0026494
Compound Name	(2R)-2alpha-(4-Hydroxyphenyl)-3beta,5,6,7-tetrahydroxy-3,4-dihydro-2H-1-benzopyran-4-one
Structure
Formula	C15H12O7
InchiKey	SPLXVVIJECEDFW-LSDHHAIUSA-N
SMILES	Oc1ccc(cc1)[C@H]1Oc2cc(O)c(c(c2C(=O)[C@@H]1O)O)O
Inchi	InChI=1S/C15H12O7/c16-7-3-1-6(2-4-7)15-14(21)13(20)10-9(22-15)5-8(17)11(18)12(10)19/h1-5,14-19,21H/t14-,15+/m0/s1
IUPAC	(2R,3R)-3,5,6,7-tetrahydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one
Molecular Weight	304.06
Pubchem Id	101353295
Chembl Id	CHEMBL3609150

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	BXGT005592	Pancreatic triacylglycerol lipase	reviewed		PNLIP	-	>100000	-	-

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
P00591	BXGT005592	Pancreatic triacylglycerol lipase	reviewed	-	PNLIP	IC50	'>'	100000	nM
P00591	BXGT005592	Pancreatic triacylglycerol lipase	reviewed	-	PNLIP	Inhibition	'='	40	%

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF04967	Cudrania tricuspidata	Cudrania tricuspidata	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}