ChemicalBook--->CAS DataBase List--->78954-23-1

78954-23-1

78954-23-1 Structure

78954-23-1 Structure
IdentificationBack Directory
[CAS]

78954-23-1
[MDL Number]

MFCD30533823
[Molecular Weight]

312.4
Chemical PropertiesBack Directory
[solubility ]

DMSO:0.0(Max Conc. mg/mL);0.0(Max Conc. mM)
[form ]

Liquid
[pka]

10.02±0.20(Predicted)
[color ]

Colorless to off-white
[InChI]

InChI=1S/C20H24O3/c1-23-20-15-17(12-14-19(20)22)11-13-18(21)10-6-5-9-16-7-3-2-4-8-16/h2-4,7-8,12,14-15,22H,5-6,9-11,13H2,1H3
[InChIKey]

TXELARZTKDBEKS-UHFFFAOYSA-N
[SMILES]

C(C1=CC=C(O)C(OC)=C1)CC(=O)CCCCC1=CC=CC=C1
[LogP]

3.720 (est)
Hazard InformationBack Directory
[Uses]

Yakuchinone A is a natural product isolated from the fruit of Alpinia oxyphylla, which can induce apoptosis and has anticancer and anti-inflammatory activities[1].
[in vivo]

Yakuchinone A (50 mg/kg, i.p., daily, 14 days) can reduce the symptoms of EAE in mice in autoimmune encephalomyelitis (EAE) mouse model[1].

Animal Model:Female C57BL/6 mice[1]
Dosage:50 mg/kg
Administration:i.p., daily, 14 days
Result:Showed a significant EAE score reduction from Day 9 to Day 15 after EAE onset.
[References]

[1] Chen Huo, et al. Microbial Transformation of Yakuchinone A and Cytotoxicity Evaluation of Its Metabolites.?Int J Mol Sci. 2022 Apr 3;23(7):3992.
[2] Kuo-Kuei Huang, et al. Alpinia oxyphylla?Fruit Extract Ameliorates Experimental Autoimmune Encephalomyelitis through the Regulation of Th1/Th17 Cells. Evid Based Complement Alternat Med. 2019 Mar 14;2019:6797030. DOI:10.1155/2019/6797030
Spectrum DetailBack Directory
[Spectrum Detail]

yakuchinone-A(78954-23-1)1HNMR
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