(-)-Epicatechin

Representations & DB's id
ChEBI:	CHEBI:90
ChEMBL:	CHEMBL583912
PubChem:	72276
IUPAC:	(2R,3R)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol
Standard InChI:	InChI=1S/C15H14O6/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7/h1-5,13,15-20H,6H2/t13-,15-/m1/s1
Standard InChI Key:	PFTAWBLQPZVEMU-UKRRQHHQSA-N
SMILES:	Oc1cc2O[C@H](c3ccc(c(c3)O)O)[C@@H](Cc2c(c1)O)O

Molecular propeties
AlogP:	1.55
Hydrogen bonds acceptors:	6
Hydrogen bonds donors:	5
Rotatable bonds:	1
Number of rings:	3
Molecular Weight:	290.08
Topological polar surface area:	110
Number of aromatic rings:	2
Fsp3:	0.2
Number of carbons:	15

Plant sources

Activity Type	Activity Value	Target Name	UniProt ID
IC50	100000 nM	Fatty acid synthase	P49327
Others	10.2 %	Fatty acid synthase	P49327
Others	10.3 %	Salivary alpha-amylase	P04745
Potency	28.2 nM	Nuclear factor NF-kappa-B p105 subunit	P19838
Potency	11220.2 nM	Lysine-specific demethylase 4D-like	B2RXH2
Potency	22387.2 nM	Lysine-specific demethylase 4D-like	B2RXH2
Potency	31622.8 nM	Thyroid stimulating hormone receptor	P16473
Potency	28.2 nM	Nuclear factor NF-kappa-B p105 subunit	P19838
Potency	31622.8 nM	Thyroid stimulating hormone receptor	P16473
Potency	1000 nM	Endoplasmic reticulum-associated amyloid beta-peptide-binding protein	Q99714
Potency	1584.9 nM	Endoplasmic reticulum-associated amyloid beta-peptide-binding protein	Q99714
Potency	10000 nM	Lysosomal alpha-glucosidase	P10253
Potency	12589.3 nM	Cytochrome P450 3A4	P08684
IC50	59642 nM	Cathepsin L	P07711
Potency	12589.3 nM	Cytochrome P450 3A4	P08684
EC50	51300 nM	Alkaline phosphatase placental-like	P10696
EC50	100000 nM	Intestinal alkaline phosphatase	P09923
Potency	10000 nM	Histone-lysine N-methyltransferase, H3 lysine-9 specific 3	Q96KQ7
Potency	3162.3 nM	Histone-lysine N-methyltransferase, H3 lysine-9 specific 3	Q96KQ7
Potency	100000 nM	Bromodomain adjacent to zinc finger domain protein 2B	Q9UIF8
IC50	407 nM	Alkaline phosphatase, tissue-nonspecific isozyme	P05186
IC50	205620 nM	Rac GTPase-activating protein 1	Q9H0H5
Ki	100000 nM	Apoptosis regulator Bcl-2	P10415
IC50	200000 nM	Microtubule-associated protein tau	P10636
Kd	5190000 nM	Thrombin	P00734
IC50	150000 nM	Thrombin	P00734