acompound

Showing entry for Cudraflavanone A

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0035663
Compound Name	Cudraflavanone A
Structure
Formula	C25H26O6
InchiKey	XPMCEWWRVJLSLM-NRFANRHFSA-N
SMILES	CC(=CCc1c(O)cc2c(c1O)C(=O)C[C@H](O2)c1cc2C=CC(Oc2cc1O)(C)C)C
Inchi	InChI=1S/C25H26O6/c1-13(2)5-6-15-17(26)11-22-23(24(15)29)19(28)12-21(30-22)16-9-14-7-8-25(3,4)31-20(14)10-18(16)27/h5,7-11,21,26-27,29H,6,12H2,1-4H3/t21-/m0/s1
IUPAC	(2S)-5,7-dihydroxy-2-(7-hydroxy-2,2-dimethylchromen-6-yl)-6-(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one
Molecular Weight	422.17
Pubchem Id	21721847
Chembl Id	CHEMBL220746

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	BXGT005162	Sterol O-acyltransferase 2	reviewed	Enzyme	SOAT2	-	24800	-	-
reviewed	BXGT009855	Sterol O-acyltransferase 1	reviewed	Enzyme	SOAT1	-	82400	-	-
reviewed	BXGT005592	Pancreatic triacylglycerol lipase	reviewed		PNLIP	-	6500	-	-
reviewed	BXGT016109	Amine oxidase [flavin-containing] A	reviewed		Maoa	-	89700	-	-

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	Inhibition	-	-	-
P35610	BXGT009855	Sterol O-acyltransferase 1	reviewed	Enzyme	SOAT1	IC50	'='	82400	nM
Q64133	BXGT016109	Amine oxidase [flavin-containing] A	reviewed	-	Maoa	IC50	'='	89700	nM
O75908	BXGT005162	Sterol O-acyltransferase 2	reviewed	Enzyme	SOAT2	IC50	'='	24800	nM
P00591	BXGT005592	Pancreatic triacylglycerol lipase	reviewed	-	PNLIP	Inhibition	'='	81	%
A0A045ISB3	BXGT026108	Phosphotyrosine protein phosphatase	unreviewed	-	ptbB	IC50	'='	5070	nM
P00591	BXGT005592	Pancreatic triacylglycerol lipase	reviewed	-	PNLIP	IC50	'='	6500	nM
A0A045ISB3	BXGT026108	Phosphotyrosine protein phosphatase	unreviewed	-	ptbB	IC50	'='	5128	nM
P9WIA1	BXGT012314	Probable low molecular weight protein-tyrosine-phosphatase	reviewed	-	ptpA	IC50	'='	2740	nM
Q9Y2R2	BXGT022243	Tyrosine-protein phosphatase non-receptor type 22	reviewed	-	PTPN22	IC50	'='	9540	nM
P18031	BXGT008369	Tyrosine-protein phosphatase non-receptor type 1	reviewed	-	PTPN1	IC50	'='	4310	nM
Q05209	BXGT026141	Tyrosine-protein phosphatase non-receptor type 12	reviewed	-	PTPN12	IC50	'='	18610	nM

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}