Strophanthidin-3-tosyloxyacetate
TL;DR: Strophanthidin-3-tosyloxyacetate (CAS 78730-59-3) is a chemical compound with molecular formula C32H40O10S and molecular weight 616.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(3S,5S,8R,9S,10S,13R,17R)-10-formyl-5,14-dihydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] 2-(4-methylphenyl)sulfonyloxyacetate
Also Known As: STTOA, Strophanthidin-3-tosyloxyacetate, [(3S,5S,8R,9S,10S,13R,17R)-10-formyl-5,14-dihydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] 2-(4-methylphenyl)sulfonyloxyacetate, Card-20(22)-enolide, 5,14-dihydroxy-3-(((((4-methylphenyl)sulfonyl)oxy)acetyl)oxy)-19-oxo-, (3beta,5beta)-, 2,2,3,3,3-pentafluoro-N'-(2,2,3,3,3-pentafluoropropanimidoyl)propanimidamide
| Molecular Formula | C32H40O10S |
|---|---|
| Molecular Weight | 616.23 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 162.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 8 |
| Exact Mass | 616.2342 |
| Heavy Atoms | 43 |
| Complexity | 1280.0 |
Chemical Identifiers
| CAS Number | 78730-59-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OCC(=O)O[C@H]2CC[C@@]3([C@H]4CC[C@@]5([C@H](CCC5([C@@H]4CC[C@@]3(C2)O)O)C6=CC(=O)OC6)C)C=O |
| InChIKey | OXAVAJJSVJTGNS-BNTNUVAQSA-N |
Product Overview
Strophanthidin-3-tosyloxyacetate (CAS 78730-59-3), with molecular formula C32H40O10S and molecular weight 616.23 g/mol. IUPAC: [(3S,5S,8R,9S,10S,13R,17R)-10-formyl-5,14-dihydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] 2-(4-methylphenyl)sulfonyloxyacetate.
Chemical Property Profile of Strophanthidin-3-tosyloxyacetate
Property Insights of Strophanthidin-3-tosyloxyacetate
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Strophanthidin-3-tosyloxyacetate. The TPSA of 162.0 Ų indicates high polarity, suggesting Strophanthidin-3-tosyloxyacetate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Strophanthidin-3-tosyloxyacetate has 2 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 Strophanthidin-3-tosyloxyacetate?
The CAS number of Strophanthidin-3-tosyloxyacetate is 78730-59-3.
What is the molecular formula of Strophanthidin-3-tosyloxyacetate?
The molecular formula of Strophanthidin-3-tosyloxyacetate is C32H40O10S.
What is the molecular weight of Strophanthidin-3-tosyloxyacetate?
The molecular weight of Strophanthidin-3-tosyloxyacetate is 616.23 g/mol.
Where can I buy Strophanthidin-3-tosyloxyacetate?
You can request a quote for Strophanthidin-3-tosyloxyacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Strophanthidin-3-tosyloxyacetate?
Yes, KEHONG BIO provides custom synthesis services for Strophanthidin-3-tosyloxyacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.