ChemicalBook--->CAS DataBase List--->973-67-1

973-67-1

973-67-1 Structure

973-67-1 Structure
IdentificationMore
[Name]

5,6,7-TRIMETHOXYFLAVONE
[CAS]

973-67-1
[Synonyms]

5,6,7-TRIMETHOXYFLAVONE
BAICALEIN-5,6,7-TRIMETHYL ETHER
BAICALEIN TRIMETHYL ETHER
5,6,7-Trimethoxyflavone,97%
2-Phenyl-5,6,7-trimethoxy-4H-1-benzopyran-4-one
5,6,7-Trimethoxy-2-phenyl-4H-1-benzopyran-4-one
[Molecular Formula]

C18H16O5
[MDL Number]

MFCD00017457
[Molecular Weight]

312.32
[MOL File]

973-67-1.mol
Chemical PropertiesBack Directory
[Melting point ]

165-167°C
[Boiling point ]

497.4±45.0 °C(Predicted)
[density ]

1.242±0.06 g/cm3(Predicted)
[storage temp. ]

Store at -20°C
[solubility ]

DMSO : 33.33 mg/mL (106.72 mM; Need ultrasonic)
[form ]

Solid
[color ]

White to light yellow
[InChI]

1S/C18H16O5/c1-20-15-10-14-16(18(22-3)17(15)21-2)12(19)9-13(23-14)11-7-5-4-6-8-11/h4-10H,1-3H3
[InChIKey]

HJNJAUYFFFOFBW-UHFFFAOYSA-N
[SMILES]

COc1cc2OC(=CC(=O)c2c(OC)c1OC)c3ccccc3
[LogP]

2.990 (est)
[CAS DataBase Reference]

973-67-1(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
[WGK Germany ]

3
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Aquatic Chronic 3
Hazard InformationBack Directory
[Uses]

5,6,7-Trimethoxyflavone is a novel p38-α MAPK inhibitor with an anti-inflammatory effect. 5,6,7-Trimethoxyflavone is isolated from several plants including Zeyhera tuberculosa, Callicarpa japonica, and Kickxia lanigera[1].
[Definition]

ChEBI: A trimethoxyflavone that is the 5,6,7-trimethyl ether derivative of baicalein. It has been isolated from the plant Callicarpa japonica and has been shown to exhibit antiviral activity.
[References]

[1] Hassan AHE, et al. Repurposing mosloflavone/5,6,7-trimethoxyflavone-resveratrol hybrids: Discovery of novel p38-α MAPK inhibitors as potent interceptors of macrophage-dependent production of proinflammatory mediators. Eur J Med Chem. 2019 Jul 9;180:253-267. DOI:10.1016/j.ejmech.2019.07.030
Spectrum DetailBack Directory
[Spectrum Detail]

5,6,7-TRIMETHOXYFLAVONE(973-67-1)1HNMR
Well-known Reagent Company Product InformationBack Directory
[Alfa Aesar]

5,6,7-Trimethoxyflavone, 97%(973-67-1)
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