Structure Database (LMSD)
Common Name
Oxyresveratrol
Systematic Name
Synonyms
No other lipid differing only in stereochemistry/bond geometry found
3D model of Oxyresveratrol
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Classification
Category
Main Class
Sub Class
String Representations
InChiKey (Click to copy)
PDHAOJSHSJQANO-OWOJBTEDSA-N
InChi (Click to copy)
InChI=1S/C14H12O4/c15-11-4-3-10(14(18)8-11)2-1-9-5-12(16)7-13(17)6-9/h1-8,15-18H/b2-1+
SMILES (Click to copy)
C1=C(O)C=C(/C=C/C2=CC=C(O)C=C2O)C=C1O
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
18
Rings
2
Aromatic Rings
2
Rotatable Bonds
2
Van der Waals Molecular Volume
220.92
Topological Polar Surface Area
80.92
Hydrogen Bond Donors
4
Hydrogen Bond Acceptors
4
logP
2.68
Molar Refractivity
68.47
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Created at
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Updated at
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