(+)-Epitaxifolin

Representations & DB's id
ChEBI:	CHEBI:32330
ChEMBL:	CHEMBL9249
PubChem:	443758
IUPAC:	(2S,3R)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-2,3-dihydrochromen-4-one
Standard InChI:	InChI=1S/C15H12O7/c16-7-4-10(19)12-11(5-7)22-15(14(21)13(12)20)6-1-2-8(17)9(18)3-6/h1-5,14-19,21H/t14-,15-/m0/s1
Standard InChI Key:	CXQWRCVTCMQVQX-GJZGRUSLSA-N
SMILES:	Oc1cc2O[C@@H](c3ccc(c(c3)O)O)[C@H](C(=O)c2c(c1)O)O

Molecular propeties
AlogP:	1.19
Hydrogen bonds acceptors:	7
Hydrogen bonds donors:	5
Rotatable bonds:	1
Number of rings:	3
Molecular Weight:	304.06
Topological polar surface area:	127
Number of aromatic rings:	2
Fsp3:	0.133
Number of carbons:	15

Plant sources

Part of plant	Plant name	Ref.
Plant	Vitis vinifera

In vitro data

Activity Type	Activity Value	Target Name	UniProt ID	Ref.
Potency	1584.9 nM	Nuclear factor NF-kappa-B p105 subunit	P19838
Potency	25118.9 nM	Hypoxia-inducible factor 1 alpha	Q16665
Potency	12589.3 nM	Arachidonate 15-lipoxygenase	P16050
Potency	25118.9 nM	Hypoxia-inducible factor 1 alpha	Q16665
Potency	12589.3 nM	Arachidonate 12-lipoxygenase	P18054
Potency	31.6 nM	MAP kinase ERK2	P28482
Potency	1584.9 nM	Nuclear factor NF-kappa-B p105 subunit	P19838
Potency	5011.9 nM	Endoplasmic reticulum-associated amyloid beta-peptide-binding protein	Q99714
Potency	10000 nM	Cytochrome P450 3A4	P08684
Potency	10000 nM	Cytochrome P450 3A4	P08684