7-O-Methylmangiferin

Representations & DB's id
ChEBI:	None
ChEMBL:	CHEMBL2436927
PubChem:	73354034
IUPAC:	1,3,6-trihydroxy-7-methoxy-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyxanthen-9-one
Standard InChI:	InChI=1S/C20H20O12/c1-29-10-2-6-9(3-7(10)22)30-11-4-8(23)19(16(26)13(11)14(6)24)32-20-18(28)17(27)15(25)12(5-21)31-20/h2-4,12,15,17-18,20-23,25-28H,5H2,1H3/t12-,15-,17+,18-,20+/m1/s1
Standard InChI Key:	ZHEOTFNZFFJRMY-DPZUNCSASA-N
SMILES:	OC[C@H]1O[C@@H](Oc2c(O)cc3c(c2O)c(=O)c2c(o3)cc(c(c2)OC)O)[C@@H]([C@H]([C@@H]1O)O)O

Molecular propeties
AlogP:	-0.75
Hydrogen bonds acceptors:	12
Hydrogen bonds donors:	7
Rotatable bonds:	4
Number of rings:	4
Molecular Weight:	452.1
Topological polar surface area:	196
Number of aromatic rings:	3
Fsp3:	0.35
Number of carbons:	20

Plant sources

Part of plant	Plant name	Ref.
Plant	Polygala tenuifolia

In vitro data

Activity Type	Activity Value	Target Name	UniProt ID	Ref.