Structure Database (LMSD)
Common Name
Isorhamnetin
Systematic Name
Synonyms
Main
Classification
String Representations
InChiKey (Click to copy)
IZQSVPBOUDKVDZ-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C16H12O7/c1-22-11-4-7(2-3-9(11)18)16-15(21)14(20)13-10(19)5-8(17)6-12(13)23-16/h2-6,17-19,21H,1H3
SMILES (Click to copy)
C1(O)C=C2OC(C3=CC=C(O)C(OC)=C3)=C(O)C(=O)C2=C(O)C=1
References
Calculated Physicochemical Properties
Heavy Atoms
23
Rings
3
Aromatic Rings
3
Rotatable Bonds
2
Van der Waals Molecular Volume
255.99
Topological Polar Surface Area
120.36
Hydrogen Bond Donors
4
Hydrogen Bond Acceptors
7
logP
3.19
Molar Refractivity
81.24
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Created at
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Updated at
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