CAS 94805-83-1|iso-Licoflavonol

Introduction:Basic information about CAS 94805-83-1|iso-Licoflavonol, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common Nameiso-Licoflavonol
CAS Number94805-83-1Molecular Weight354.35
Density1.4±0.1 g/cm3Boiling Point601.2±55.0 °C at 760 mmHg
Molecular FormulaC20H18O6Melting Point/
MSDS/Flash Point217.4±25.0 °C

Names

NameIsolicoflavonol
SynonymMore Synonyms

iso-Licoflavonol BiologicalActivity

DescriptionIsolicoflavonol potently inhibits hCES2A(Human carboxylesterase 2)-mediated fluorescein diacetate hydrolysis in a reversible and mixed inhibition manner, with Ki values less than 1.0 μM[1].
Related CatalogResearch Areas >>OthersSignaling Pathways >>Others >>Others
References

[1]. Song YQ, et al. Discovery of hCES2A inhibitors from Glycyrrhiza inflata via combination of docking-based virtual screening and fluorescence-based inhibition assays. Food Funct. 2021;12(1):162-176.

Chemical & Physical Properties

Density1.4±0.1 g/cm3
Boiling Point601.2±55.0 °C at 760 mmHg
Molecular FormulaC20H18O6
Molecular Weight354.35
Flash Point217.4±25.0 °C
Exact Mass354.110352
PSA111.13000
LogP4.15
Vapour Pressure0.0±1.8 mmHg at 25°C
Index of Refraction1.700
InChIKeyPGCKDCPTJAQQSQ-UHFFFAOYSA-N
SMILESCC(C)=CCc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O)ccc1O
Storage condition2-8C

Synonyms

4H-1-Benzopyran-4-one, 3,5,7-trihydroxy-2-[4-hydroxy-3-(3-methyl-2-buten-1-yl)phenyl]-
3,5,7-Trihydroxy-2-[4-hydroxy-3-(3-methyl-2-buten-1-yl)phenyl]-4H-chromen-4-one
iso-Licoflavonol
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