Structure Database (LMSD)
Common Name
Rhaponticin
Systematic Name
3',5-Dihydroxy-4'-methoxystilbene 3-O-β-D-glucopyranoside
Synonyms
- Rhapontin
Main
Classification
Category
Main Class
Sub Class
String Representations
InChiKey (Click to copy)
GKAJCVFOJGXVIA-DXKBKAGUSA-N
InChi (Click to copy)
InChI=1S/C21H24O9/c1-28-16-5-4-11(8-15(16)24)2-3-12-6-13(23)9-14(7-12)29-21-20(27)19(26)18(25)17(10-22)30-21/h2-9,17-27H,10H2,1H3/b3-2+/t17-,18-,19+,20-,21-/m1/s1
SMILES (Click to copy)
C1=C(O)C=C(/C=C/C2=CC(O)=C(OC)C=C2)C=C1O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO
References
Calculated Physicochemical Properties
Heavy Atoms
30
Rings
3
Aromatic Rings
2
Rotatable Bonds
6
Van der Waals Molecular Volume
373.61
Topological Polar Surface Area
151.14
Hydrogen Bond Donors
6
Hydrogen Bond Acceptors
9
logP
2.17
Molar Refractivity
109.14
Admin
Created at
-
Updated at
5th Feb 2022