Isosinensetin

Datasheet MSDS
Catalog Number
ANC02527
Product Name
Isosinensetin
CAS Number
17290-70-9
IUPAC Name
2-(3,4-dimethoxyphenyl)-5,7,8-trimethoxychromen-4-one
Synonyms
3',4',5,7,8-Pentamethoxyflavone; 5,7,8,3',4'-Pentamethoxyflavone; 6-Demethoxynobiletin
Molecular Formula
C20H20O7
Molecular Weight
372.369
Appearance
Powder
Purity
>98%
Density
1.2±0.1g/cm3
Description
Isosinensetin belongs to the class of organic compounds known as 8-o-methylated flavonoids. These are flavonoids with methoxy groups attached to the C8 atom of the flavonoid backbone. Thus, isosinensetin is considered to be a flavonoid lipid molecule. Isosinensetin exists as a solid and is considered to be practically insoluble (in water) and relatively neutral. Within the cell, isosinensetin is primarily located in the membrane (predicted from logP). Outside of the human body, isosinensetin can be found in citrus, fruits, mandarin orange (clementine, tangerine), and sweet orange. This makes isosinensetin a potential biomarker for the consumption of these food products.
SMILES
COC1=C(C=C(C=C1)C2=CC(=O)C3=C(O2)C(=C(C=C3OC)OC)OC)OC
InChI
InChI=1S/C20H20O7/c1-22-13-7-6-11(8-15(13)23-2)14-9-12(21)18-16(24-3)10-17(25-4)19(26-5)20(18)27-14/h6-10H,1-5H3
InChI Key
UYCWETIUOAGWIL-UHFFFAOYSA-N
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