ChemicalBook--->CAS DataBase List--->114420-67-6

114420-67-6

114420-67-6 Structure

114420-67-6 Structure
IdentificationBack Directory
[Name]

BRUSATOL
[CAS]

114420-67-6
[Synonyms]

BRUSATOL
Regaloside B
β-D-Glucopyranoside, (1S)-2-(acetyloxy)-1-[[[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]methyl]ethyl
[Molecular Formula]

C26H32O11
[MDL Number]

MFCD01746220
[MOL File]

114420-67-6.mol
[Molecular Weight]

442.41
Chemical PropertiesBack Directory
[Boiling point ]

727.5±60.0 °C(Predicted)
[density ]

1.46±0.1 g/cm3(Predicted)
[storage temp. ]

Store at -20°C
[form ]

Solid
[pka]

8.58±0.15(Predicted)
[color ]

White to off-white
[InChI]

InChI=1S/C20H26O11/c1-11(22)28-9-14(30-20-19(27)18(26)17(25)15(8-21)31-20)10-29-16(24)7-4-12-2-5-13(23)6-3-12/h2-7,14-15,17-21,23,25-27H,8-10H2,1H3
[InChIKey]

YQKQOLPNKNHLBO-UHFFFAOYSA-N
[SMILES]

O(C1C(C(O)C(O)C(CO)O1)O)C(COC(=O)C)COC(=O)C=CC1C=CC(O)=CC=1
[CAS DataBase Reference]

114420-67-6
Questions And AnswerBack Directory
[Description]

Brusatol is a natural quassinoid that shows a potential therapeutic use in cancer models by the inhibition of Nuclear factor erythroid 2-related factor 2 (Nrf2) and is capable of inducing a variety of biological effects. The effects of Brusatol on oocyte meiosis has not been addressed.
Hazard InformationBack Directory
[Uses]

Clinically, the research shows brusatol enhances the efficacy of chemotherapy by inhibiting the Nrf2-mediated defense mechanism, and it provokes a rapid and transient inhibition of Nrf2 signaling and sensitizes mammalian cells to chemical toxicity. Brusatol overcomes chemoresistance through inhibition of protein translation.
[storage]

Store at -20°C
Spectrum DetailBack Directory
[Spectrum Detail]

BRUSATOL(114420-67-6)1HNMR
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