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Chemical structure of Hexamethylquercetagetin

GC30734

Hexamethylquercetagetin

Also listed as Hexamethylquercetagetin (Hexa-O-methylquercetagetin)

Hexamethylquercetagetin (Hexa-O-methylquercetagetin) is a polymethoxylated flavone in peels of citrus cultivars

ChemicalCAS1251-84-9MW402.39FormulaC21H22O8
CAS number
1251-84-9
Molecular weight
402.39
Formula
C21H22O8
Solubility
Soluble in DMSO
InChIKey
CHXSDKWBSFDZEU-UHFFFAOYSA-N
Catalogue number
GC30734
Brand
GLPBIO
Computed properties PubChem CID 386331 · XLogP 3.2 · TPSA 81.7 Ų · H-bond donors 0
XLogP
3.2
TPSA
81.7 Ų
H-bond donors
0
H-bond acceptors
8
Rotatable bonds
7
Heavy atoms
29

SMILES COC1=C(C=C(C=C1)C2=C(C(=O)C3=C(C(=C(C=C3O2)OC)OC)OC)OC)OC

Computed descriptors from PubChem (CID 386331), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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