Silymonin
TL;DR: Silymonin (CAS 70815-31-5) is a chemical compound with molecular formula C25H22O9 and molecular weight 466.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,3R,6R,7R,10R)-8-[(2S)-5,7-dihydroxy-4-oxo-2,3-dihydrochromen-2-yl]-3-hydroxy-10-(4-hydroxy-3-methoxyphenyl)-4-oxatricyclo[4.3.1.03,7]dec-8-en-2-one
Also Known As: Silymonin, (+)-Silymonin, SILYMONIN hplc, SILIMONIN, Ribosomal protein L7-L12
| Molecular Formula | C25H22O9 |
|---|---|
| Molecular Weight | 466.13 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 143.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 3 |
| Exact Mass | 466.12637 |
| Heavy Atoms | 34 |
| Complexity | 903.0 |
Chemical Identifiers
| CAS Number | 70815-31-5 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)[C@@H]2[C@H]3CO[C@@]4([C@H]3C(=C[C@H]2C4=O)[C@@H]5CC(=O)C6=C(C=C(C=C6O5)O)O)O)O |
| InChIKey | YBGWTZSEYYMFJI-AXUSBXICSA-N |
Product Overview
Silymonin (CAS 70815-31-5), with molecular formula C25H22O9 and molecular weight 466.13 g/mol. IUPAC: (1R,3R,6R,7R,10R)-8-[(2S)-5,7-dihydroxy-4-oxo-2,3-dihydrochromen-2-yl]-3-hydroxy-10-(4-hydroxy-3-methoxyphenyl)-4-oxatricyclo[4.3.1.03,7]dec-8-en-2-one.
Chemical Property Profile of Silymonin
Property Insights of Silymonin
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Silymonin. The TPSA of 143.0 Ų indicates high polarity, suggesting Silymonin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Silymonin has 4 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Silymonin?
The CAS number of Silymonin is 70815-31-5.
What is the molecular formula of Silymonin?
The molecular formula of Silymonin is C25H22O9.
What is the molecular weight of Silymonin?
The molecular weight of Silymonin is 466.13 g/mol.
Where can I buy Silymonin?
You can request a quote for Silymonin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Silymonin?
Yes, KEHONG BIO provides custom synthesis services for Silymonin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.