Silicristin
TL;DR: Silicristin (CAS 879325-58-3) is a chemical compound with molecular formula C25H22O10 and molecular weight 482.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5,7-trihydroxy-2-[7-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-2,3-dihydro-1-benzofuran-5-yl]-2,3-dihydrochromen-4-one
Also Known As: Silicristin, Silychristin, Silychristin B, Silychrystin, Silymarin II
| Molecular Formula | C25H22O10 |
|---|---|
| Molecular Weight | 482.12 g/mol |
| LogP | 2.4045 |
| Topological Polar Surface Area | 166.14 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 4 |
| Exact Mass | 482.1213 |
| Heavy Atoms | 35 |
| Complexity | 1334.3082 |
Chemical Identifiers
| CAS Number | 879325-58-3 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)C2C(C3=C(O2)C(=CC(=C3)C4C(C(=O)C5=C(C=C(C=C5O4)O)O)O)O)CO)O |
Product Overview
Silicristin (CAS 879325-58-3), with molecular formula C25H22O10 and molecular weight 482.12 g/mol. IUPAC: 3,5,7-trihydroxy-2-[7-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-2,3-dihydro-1-benzofuran-5-yl]-2,3-dihydrochromen-4-one.
Chemical Property Profile of Silicristin
Property Insights of Silicristin
The XLogP value of 2.4045 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Silicristin. The TPSA of 166.14 Ų indicates high polarity, suggesting Silicristin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Silicristin has 6 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Silicristin?
The CAS number of Silicristin is 879325-58-3.
What is the molecular formula of Silicristin?
The molecular formula of Silicristin is C25H22O10.
What is the molecular weight of Silicristin?
The molecular weight of Silicristin is 482.12 g/mol.
Where can I buy Silicristin?
You can request a quote for Silicristin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Silicristin?
Yes, KEHONG BIO provides custom synthesis services for Silicristin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.