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ChemicalBook--->CAS DataBase List--->802918-57-6

802918-57-6

802918-57-6 Structure

802918-57-6 Structure
IdentificationBack Directory
[Name]

Silybin
[CAS]

802918-57-6
[Synonyms]

Silybin A,B (Mixture)
Silybin (Mixture of Diastereomers)
4H-1-Benzopyran-4-one, 2-[2,3-dihydro-3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-1,4-benzodioxin-6-yl]-2,3-dihydro-3,5,7-trihydroxy-, (2R,3R)-
[EINECS(EC#)]

806-403-5
[Molecular Formula]

C25H22O10
[MOL File]

802918-57-6.mol
[Molecular Weight]

482.44
Chemical PropertiesBack Directory
[Melting point ]

152-153°C
[Boiling point ]

793.0±60.0 °C(Predicted)
[density ]

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

Refrigerator
[solubility ]

Acetone (Sparingly, Sonicated, Heated), DMSO (Slightly), Methanol (Slightly, Heated)
[form ]

Solid
[pka]

7.39±0.60(Predicted)
[color ]

Pale Yellow to Beige
[InChIKey]

SEBFKMXJBCUCAI-DBMPWETRSA-N
[SMILES]

[C@H]1(C2=CC=C3OC(CO)C(C4=CC=C(O)C(OC)=C4)OC3=C2)OC2=CC(O)=CC(O)=C2C(=O)[C@@H]1O
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

36/37/38
[Safety Statements ]

26-37/39
[WGK Germany ]

3
[RTECS ]

DJ2981770
Hazard InformationBack Directory
[Chemical Properties]

Beige Solid
[Uses]

Hepatoprotectant. In nature, the flavonolignan Silybin occurs as a mixture of two diastereomers, Silybin A and Silybin B.
[General Description]

Produced and qualified by HWI pharma services GmbH.
Exact content by quantitative NMR can be found on the certificate.
[storage]

Store at -20°C
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