BDBM243067 11-O-protocatechuoylbergenin (5)

SMILES: COc1c(O)cc2C(=O)OC3[C@@H](O)[C@H](O)[C@@H](COC(=O)c4ccc(O)c(O)c4)OC3c2c1O

InChI Key: InChIKey=MFNRPVDJVZFOAE-DHFKODKKSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 243067   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Alpha-glucosidase MAL12 (Saccharomyces cerevisiae)	BDBM243067 (11-O-protocatechuoylbergenin (5)) Show SMILES COc1c(O)cc2C(=O)OC3[C@@H](O)[C@H](O)[C@@H](COC(=O)c4ccc(O)c(O)c4)OC3c2c1O |r| Show InChI InChI=1S/C21H20O12/c1-30-17-11(24)5-8-13(15(17)26)18-19(33-21(8)29)16(27)14(25)12(32-18)6-31-20(28)7-2-3-9(22)10(23)4-7/h2-5,12,14,16,18-19,22-27H,6H2,1H3/t12-,14-,16+,18?,19?/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.90E+5	n/a	n/a	n/a	n/a	7.0	25
Kinki University					Assay Description α-glucosidase (25 μL, 0.2 U/mL), 25 μL of various concentrations of samples, and 175 μL of 50 mM sodium phosphate buffer (pH 7.0)...				J Enzyme Inhib Med Chem 28: 1162-70 (2013) Article DOI: 10.3109/14756366.2012.719503 BindingDB Entry DOI: 10.7270/Q22F7MCR
					More data for this Ligand-Target Pair