ChemicalBook--->CAS DataBase List--->34000-39-0

34000-39-0

34000-39-0 Structure

34000-39-0 Structure
IdentificationBack Directory
[Name]

HOMOBUTEIN
[CAS]

34000-39-0
[Synonyms]

HOMOBUTEIN
homobitein
HOMOBUTEIN hplc
Einecs 251-782-7
3-O-methylbutein
HOMOBUTEIN WITH HPLC
4,2',4'-Trihydroxy-3-methoxychalcone
3-METHOXY-2',4',4-TRIHYDROXYCHALCONE
2',4,4'-TRIHYDROXY-3-METHOXY CHALCONE
(E)-2',4,4'-trihydroxy-3-methoxychalcone
(E)-1-(2,4-Dihydroxyphenyl)-3-(4-hydroxy-3-methoxyphenyl)-2-propen-1-one
2-Propen-1-one, 1-(2,4-dihydroxyphenyl)-3-(4-hydroxy-3-methoxyphenyl)-, (2E)-
[EINECS(EC#)]

251-782-7
[Molecular Formula]

C16H14O5
[MDL Number]

MFCD00016769
[MOL File]

34000-39-0.mol
[Molecular Weight]

286.28
Chemical PropertiesBack Directory
[Melting point ]

207-212°C
[Boiling point ]

523.8±50.0 °C(Predicted)
[density ]

1.369±0.06 g/cm3(Predicted)
[form ]

Solid
[pka]

7.43±0.35(Predicted)
[color ]

Light yellow to yellow
[LogP]

2.880 (est)
Hazard InformationBack Directory
[Uses]

Homobutein a natural chalcones (can be found in many medicinal plants, fruits, vegetables, spices and nuts), is a potent HDACs/NF-κB dual inhibitor with IC50s of 190 and 38 μM, respectively. Homobutein also a chelator of iron (II and III) cations, shows various activities, including anticancer, anti-inflammatory, antiparasite and antioxidation[1][2][3][4].
[Definition]

ChEBI:Homobutein is a member of chalcones.
[IC 50]

Toxoplasma
[References]

[1] Orlikova B, et al. Natural chalcones as dual inhibitors of HDACs and NF-κB. Oncol Rep. 2012 Sep;28(3):797-805. DOI:10.3892/or.2012.1870
[2] Adeyemi OS, et al. In Vitro Screening to Identify Anti-Toxoplasma Compounds and In Silico Modeling for Bioactivities and Toxicity. Yale J Biol Med. 2019 Sep 20;92(3):369-383. PMID:31543702
[3] Yenesew A, et al. Anti-plasmodial flavonoids from the stem bark of Erythrina abyssinica. Phytochemistry. 2004 Nov;65(22):3029-32. DOI:10.1016/j.phytochem.2004.08.050
[4] Serobatse K, et al. Antioxidant and antimalarial properties of butein and homobutein based on their ability to chelate iron (II and III) cations: a DFT study in vacuo and in solution. European Food Research and Technology, 2016, 242(1): 71-90.
Spectrum DetailBack Directory
[Spectrum Detail]

HOMOBUTEIN(34000-39-0)1HNMR
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