Scilliroside, (3beta,6beta)-
TL;DR: Scilliroside, (3beta,6beta)- (CAS 507-60-8) is a chemical compound with molecular formula C32H44O12 and molecular weight 620.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[8,14-dihydroxy-10,13-dimethyl-17-(6-oxopyran-3-yl)-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3,6,7,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-6-yl] acetate
Also Known As: Scillirosan, Scillirosid, Silmurin, SCILLIROSIDE, Silmine
| Molecular Formula | C32H44O12 |
|---|---|
| Molecular Weight | 620.28 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 192.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 6 |
| Exact Mass | 620.28326 |
| Heavy Atoms | 44 |
| Complexity | 1280.0 |
Chemical Identifiers
| CAS Number | 507-60-8 |
|---|---|
| SMILES | CC(=O)OC1CC2(C(CCC3(C2(CCC3C4=COC(=O)C=C4)O)C)C5(C1=CC(CC5)OC6C(C(C(C(O6)CO)O)O)O)C)O |
| InChIKey | LSMIOFMZNVEEBR-UHFFFAOYSA-N |
Product Overview
Scilliroside, (3beta,6beta)- (CAS 507-60-8), with molecular formula C32H44O12 and molecular weight 620.28 g/mol. IUPAC: [8,14-dihydroxy-10,13-dimethyl-17-(6-oxopyran-3-yl)-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3,6,7,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-6-yl] acetate.
Chemical Property Profile of Scilliroside, (3beta,6beta)-
Property Insights of Scilliroside, (3beta,6beta)-
The XLogP value of -0.4 indicates that Scilliroside, (3beta,6beta)- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 192.0 Ų indicates high polarity, suggesting Scilliroside, (3beta,6beta)- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Scilliroside, (3beta,6beta)- has 6 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Scilliroside, (3beta,6beta)-?
The CAS number of Scilliroside, (3beta,6beta)- is 507-60-8.
What is the molecular formula of Scilliroside, (3beta,6beta)-?
The molecular formula of Scilliroside, (3beta,6beta)- is C32H44O12.
What is the molecular weight of Scilliroside, (3beta,6beta)-?
The molecular weight of Scilliroside, (3beta,6beta)- is 620.28 g/mol.
Where can I buy Scilliroside, (3beta,6beta)-?
You can request a quote for Scilliroside, (3beta,6beta)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Scilliroside, (3beta,6beta)-?
Yes, KEHONG BIO provides custom synthesis services for Scilliroside, (3beta,6beta)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.