Glucostrospeside
TL;DR: Glucostrospeside (CAS 752-61-4) is a chemical compound with molecular formula C36H56O14 and molecular weight 712.37 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[14,16-dihydroxy-3-[3-hydroxy-4-methoxy-6-methyl-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one
Also Known As: Glucostrospeside, Digitalum verum, Digitalinum verum, DIGITALIN, Digitalin (glycoside)
| Molecular Formula | C36H56O14 |
|---|---|
| Molecular Weight | 712.37 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 214.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 7 |
| Exact Mass | 712.367 |
| Heavy Atoms | 50 |
| Complexity | 1300.0 |
Chemical Identifiers
| CAS Number | 752-61-4 |
|---|---|
| SMILES | CC1C(C(C(C(O1)OC2CCC3(C(C2)CCC4C3CCC5(C4(CC(C5C6=CC(=O)OC6)O)O)C)C)O)OC)OC7C(C(C(C(O7)CO)O)O)O |
| InChIKey | CKNOLMVLQUPVMU-UHFFFAOYSA-N |
Product Overview
Glucostrospeside (CAS 752-61-4), with molecular formula C36H56O14 and molecular weight 712.37 g/mol. IUPAC: 3-[14,16-dihydroxy-3-[3-hydroxy-4-methoxy-6-methyl-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one.
Chemical Property Profile of Glucostrospeside
Property Insights of Glucostrospeside
The XLogP value of -0.3 indicates that Glucostrospeside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 214.0 Ų indicates high polarity, suggesting Glucostrospeside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Glucostrospeside has 7 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Glucostrospeside?
The CAS number of Glucostrospeside is 752-61-4.
What is the molecular formula of Glucostrospeside?
The molecular formula of Glucostrospeside is C36H56O14.
What is the molecular weight of Glucostrospeside?
The molecular weight of Glucostrospeside is 712.37 g/mol.
Where can I buy Glucostrospeside?
You can request a quote for Glucostrospeside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Glucostrospeside?
Yes, KEHONG BIO provides custom synthesis services for Glucostrospeside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.