Structure Database (LMSD)
Common Name
Isoginkgetin
Systematic Name
8-[5-(5,7-dihydroxy-4-oxo-4H-1-benzopyran-2-yl)-2-methoxyphenyl]-5,7-dihydroxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one
Synonyms
Main
Classification
Category
Main Class
Sub Class
String Representations
InChiKey (Click to copy)
HUOOMAOYXQFIDQ-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C32H22O10/c1-39-18-6-3-15(4-7-18)26-14-24(38)31-22(36)12-21(35)29(32(31)42-26)19-9-16(5-8-25(19)40-2)27-13-23(37)30-20(34)10-17(33)11-28(30)41-27/h3-14,33-36H,1-2H3
SMILES (Click to copy)
C1(O)=CC2OC(C3C=CC(OC)=C(C4=C(O)C=C(O)C5C(=O)C=C(C6=CC=C(OC)C=C6)OC4=5)C=3)=CC(=O)C=2C(O)=C1
References
Calculated Physicochemical Properties
Heavy Atoms
42
Rings
6
Aromatic Rings
6
Rotatable Bonds
5
Van der Waals Molecular Volume
468.26
Topological Polar Surface Area
159.80
Hydrogen Bond Donors
4
Hydrogen Bond Acceptors
10
logP
7.54
Molar Refractivity
154.81
Admin
Created at
8th Jun 2021
Updated at
8th Jun 2021