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Chemical structure of 3-Hydroxy-5,7,4′-trimethoxyflavone

GC72007

3-Hydroxy-5,7,4′-trimethoxyflavone

Also known as 3-hydroxy-5,7-dimethoxy-2-(4-methoxyphenyl)chromen-4-one

3-Hydroxy-5,7,4′-trimethoxyflavone is a flavonol can be isolated from Cucubalus baccifer

ChemicalCAS1098-92-6MW328.32FormulaC18H16O6
CAS number
1098-92-6
Molecular weight
328.32
Formula
C18H16O6
Solubility
DMSO ： 100 mg/mL (304·58 mM; Need ultrasonic; Hygroscopic DMSO has a significant impact on the solubility of product, please use newly opened DMSO)
InChIKey
SGPXJCVFCJANKN-UHFFFAOYSA-N
Catalogue number
GC72007
Brand
GLPBIO
Computed properties PubChem CID 624831 · XLogP 2.3 · TPSA 74.2 Ų · H-bond donors 1
XLogP
2.3
TPSA
74.2 Ų
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
24

SMILES COC1=CC=C(C=C1)C2=C(C(=O)C3=C(O2)C=C(C=C3OC)OC)O

Computed descriptors from PubChem (CID 624831), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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