Strophanthidin digitaloside
TL;DR: Strophanthidin digitaloside (CAS 65681-32-5) is a chemical compound with molecular formula C30H44O10 and molecular weight 564.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S,5S,8R,9S,10S,13R,14S,17R)-3-[(3S,4R,6S)-3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl]oxy-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]phenanthrene-10-carbaldehyde
Also Known As: Strophanthidin digitaloside, Strophanthidin-Dtl, (3S,5S,8R,9S,10S,13R,14S,17R)-3-[(3S,4R,6S)-3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl]oxy-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]phenanthrene-10-carbaldehyde, Card-20(22)-enolide, 3-((6-deoxy-3-O-methyl-D-galactosyl)oxy)-5,14-dihydroxy-19-oxo-, (3beta,5beta)-
| Molecular Formula | C30H44O10 |
|---|---|
| Molecular Weight | 564.29 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 152.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 5 |
| Exact Mass | 564.29346 |
| Heavy Atoms | 40 |
| Complexity | 1060.0 |
Chemical Identifiers
| CAS Number | 65681-32-5 |
|---|---|
| SMILES | C[C@H]1C([C@H]([C@@H](C(O1)O[C@H]2CC[C@@]3([C@H]4CC[C@@]5([C@H](CC[C@@]5([C@@H]4CC[C@@]3(C2)O)O)C6=CC(=O)OC6)C)C=O)O)OC)O |
| InChIKey | DPKLBEWKXLCUQW-QSPNVOCOSA-N |
Product Overview
Strophanthidin digitaloside (CAS 65681-32-5), with molecular formula C30H44O10 and molecular weight 564.29 g/mol. IUPAC: (3S,5S,8R,9S,10S,13R,14S,17R)-3-[(3S,4R,6S)-3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl]oxy-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]phenanthrene-10-carbaldehyde.
Chemical Property Profile of Strophanthidin digitaloside
Property Insights of Strophanthidin digitaloside
The XLogP value of -0.1 indicates that Strophanthidin digitaloside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 152.0 Ų indicates high polarity, suggesting Strophanthidin digitaloside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Strophanthidin digitaloside has 4 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 digitaloside?
The CAS number of Strophanthidin digitaloside is 65681-32-5.
What is the molecular formula of Strophanthidin digitaloside?
The molecular formula of Strophanthidin digitaloside is C30H44O10.
What is the molecular weight of Strophanthidin digitaloside?
The molecular weight of Strophanthidin digitaloside is 564.29 g/mol.
Where can I buy Strophanthidin digitaloside?
You can request a quote for Strophanthidin digitaloside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Strophanthidin digitaloside?
Yes, KEHONG BIO provides custom synthesis services for Strophanthidin digitaloside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.