Myricitrin

Representations & DB's id
ChEBI:	CHEBI:70082
ChEMBL:	CHEMBL522983
PubChem:	5281673
IUPAC:	5,7-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-2-(3,4,5-trihydroxyphenyl)chromen-4-one
Standard InChI:	InChI=1S/C21H20O12/c1-6-14(26)17(29)18(30)21(31-6)33-20-16(28)13-9(23)4-8(22)5-12(13)32-19(20)7-2-10(24)15(27)11(25)3-7/h2-6,14,17-18,21-27,29-30H,1H3/t6-,14-,17+,18+,21-/m0/s1
Standard InChI Key:	DCYOADKBABEMIQ-OWMUPTOHSA-N
SMILES:	Oc1cc(O)c2c(c1)oc(c(c2=O)O[C@@H]1O[C@@H](C)[C@@H]([C@H]([C@H]1O)O)O)c1cc(O)c(c(c1)O)O

Molecular propeties
AlogP:	0.19
Hydrogen bonds acceptors:	12
Hydrogen bonds donors:	8
Rotatable bonds:	3
Number of rings:	4
Molecular Weight:	464.1
Topological polar surface area:	207
Number of aromatic rings:	3
Fsp3:	0.286
Number of carbons:	21

Plant sources

Activity Type	Activity Value	Target Name	UniProt ID
IC50	30965 nM	Mannose-6-phosphate isomerase	P34949
Potency	28183.8 nM	ATP-dependent DNA helicase Q1	P46063
Potency	2238.7 nM	Lysine-specific demethylase 4D-like	B2RXH2
Potency	891.3 nM	Tyrosyl-DNA phosphodiesterase 1	Q9NUW8
Potency	17782.8 nM	Microtubule-associated protein tau	P10636
Potency	25118.9 nM	Aldehyde dehydrogenase 1A1	P00352
Potency	3548.1 nM	Microtubule-associated protein tau	P10636
Potency	3162.3 nM	Lysosomal alpha-glucosidase	P10253
Potency	10000 nM	DNA polymerase beta	P06746
Potency	31622.8 nM	Lysine-specific demethylase 4A	O75164
Potency	44668.4 nM	Histone-lysine N-methyltransferase, H3 lysine-9 specific 3	Q96KQ7
Potency	50118.7 nM	Bromodomain adjacent to zinc finger domain protein 2B	Q9UIF8
Potency	15848.9 nM	Glutaminase kidney isoform, mitochondrial	O94925
Potency	35481.3 nM	Ataxin-2	Q99700