7-Demethoxy-7-D-(Glucosyloxy)-Homopterocarpin

Representations & DB's id
ChEBI:	CHEBI:80390
ChEMBL:	CHEMBL517330
PubChem:	23724664
IUPAC:	(2S,3R,4S,5S,6R)-2-[[(6aR,11aR)-9-methoxy-6a,11a-dihydro-6H-[1]benzofuro[3,2-c]chromen-3-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
Standard InChI:	InChI=1S/C22H24O9/c1-27-10-2-4-12-14-9-28-15-7-11(3-5-13(15)21(14)30-16(12)6-10)29-22-20(26)19(25)18(24)17(8-23)31-22/h2-7,14,17-26H,8-9H2,1H3/t14-,17+,18+,19-,20+,21-,22+/m0/s1
Standard InChI Key:	PVEMGMOWXQUWRD-NJAOXFEXSA-N
SMILES:	OC[C@H]1O[C@@H](Oc2ccc3c(c2)OC[C@@H]2[C@H]3Oc3c2ccc(c3)OC)[C@@H]([C@H]([C@@H]1O)O)O

Molecular propeties
AlogP:	0.48
Hydrogen bonds acceptors:	9
Hydrogen bonds donors:	4
Rotatable bonds:	4
Number of rings:	5
Molecular Weight:	432.14
Topological polar surface area:	127
Number of aromatic rings:	2
Fsp3:	0.455
Number of carbons:	22

Plant sources

Part of plant	Plant name	Ref.
Plant	Ononis spinosa

In vitro data

Activity Type	Activity Value	Target Name	UniProt ID	Ref.