Silymarin
TL;DR: Silymarin (CAS 65666-07-1) is a chemical compound with molecular formula C25H22O10 and molecular weight 482.1213 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,5,7-trihydroxy-2-[3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-2,3-dihydrochromen-4-one
Also Known As: SILYMARIN, Silybin, silibinin, Silybin B, Legalon
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C25H22O10 |
| Molecular Weight | 482.1213 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 155.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 4 |
| Exact Mass | 482.1213 Da |
| Heavy Atoms | 35 |
| Complexity | 750.0 |
| Melting Point | 167 °C |
| SMILES | COC1=C(C=CC(=C1)C2C(OC3=C(O2)C=C(C=C3)C4C(C(=O)C5=C(C=C(C=C5O4)O)O)O)CO)O |
| InChIKey | SEBFKMXJBCUCAI-UHFFFAOYSA-N |
Product Description
Applications: Silymarin is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
A pharmaceutical intermediate supplied by CoreyChem, Silymarin (CAS 65666-07-1) has the molecular formula C25H22O10 and a molecular weight of 482.12 g/mol. Synonyms include SILYMARIN and Silybin.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Silymarin
Property Insights of Silymarin
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Silymarin. The TPSA of 155.0 Ų indicates high polarity, suggesting Silymarin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Silymarin has 5 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Silymarin?
The CAS number of Silymarin is 65666-07-1.
What is the molecular formula of Silymarin?
The molecular formula of Silymarin is C25H22O10.
What is the molecular weight of Silymarin?
The molecular weight of Silymarin is 482.1213 g/mol.
What are the applications of Silymarin?
Silymarin is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and...
Where can I buy Silymarin?
You can request a quote for Silymarin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Silymarin?
Yes, CoreyChem provides custom synthesis services for Silymarin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.