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ChemicalBook--->CAS DataBase List--->36804-17-8

36804-17-8

36804-17-8 Structure

36804-17-8 Structure
IdentificationBack Directory
[Name]

SILYBIN (MIXTURE OF SILYBIN A AND SILYBIN B)
[CAS]

36804-17-8
[Synonyms]

Silybin 
Silybin A,SB-A
Silibinin, 98%(total of isomers)
(Mixture of Silybin A and Silybin B)
Silybin(mixtureofSilybinAandSilybinB)>
SILYBIN (MIXTURE OF SILYBIN A AND SILYBIN B)
2,3-dihydro-3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-6-(3,5,7-trihydroxy-4-oxobenzopyran-2-yl)benzodioxine
Silibinin 2,3-Dihydro-3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-6-(3,5,7-trihydroxy-4-oxobenzopyran-2-yl)benzodioxine
(2R,3R)-3,5,7-trihydroxy-2-[3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-2,3-dihydro-4H-chromen-4-one
4H-1-Benzopyran-4-one, 2-[(2R,3R)-2,3-dihydro-3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-1,4-benzodioxin-6-yl]-2,3-dihydro-3,5,7-trihydroxy-, (2R,3R)-rel-
[Molecular Formula]

C25H22O10
[MDL Number]

MFCD00872186
[MOL File]

36804-17-8.mol
[Molecular Weight]

482.44
Chemical PropertiesBack Directory
[Melting point ]

160 °C
[Boiling point ]

793.0±60.0 °C(Predicted)
[density ]

1.527±0.06 g/cm3(Predicted)
[storage temp. ]

Freezer
[form ]

powder to crystaline
[pka]

7.39±0.60(Predicted)
[color ]

White to Orange to Green
[Merck ]

14,8532
Safety DataBack Directory
[Symbol(GHS) ]


GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319
[Precautionary statements ]

P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
[RTECS ]

DJ2981770
[HS Code ]

2932.99.7000
Hazard InformationBack Directory
[Uses]

(±)-Silybin is the racemate of Silybin (HY-N0779A). Silybin induces apoptosis and exhibits hepatoprotective, antioxidant, anti-inflammatory, anti-cancer activity[1][2].
[Definition]

ChEBI: Silibinin is a flavonolignan isolated from milk thistle, Silybum marianum, that has been shown to exhibit antioxidant and antineoplastic activities. It has a role as an antioxidant, an antineoplastic agent, a hepatoprotective agent and a plant metabolite. It is a flavonolignan, a polyphenol, an aromatic ether, a benzodioxine and a secondary alpha-hydroxy ketone.
[References]

[1] Silvia Zappavigna, et al. Silybin-Induced Apoptosis Occurs in Parallel to the Increase of Ceramides Synthesis and miRNAs Secretion in Human Hepatocarcinoma Cells. Int J Mol Sci. 2019 May 3;20(9):2190. DOI:10.3390/ijms20092190
[2] Runbin Sun, et al. Silybin ameliorates hepatic lipid accumulation and modulates global metabolism in an NAFLD mouse model. Biomed Pharmacother. 2020 Mar;123:109721. DOI:10.1016/j.biopha.2019.109721
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