Card-20(22)-enolide, 1,3,5,11,14,19-hexahydroxy-, (1beta,3beta,5beta,11alpha)-
TL;DR: Card-20(22)-enolide, 1,3,5,11,14,19-hexahydroxy-, (1beta,3beta,5beta,11alpha)- (CAS 51222-26-5) is a chemical compound with molecular formula C23H34O8 and molecular weight 438.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[1,3,5,11,14-pentahydroxy-10-(hydroxymethyl)-13-methyl-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2H-furan-5-one
Also Known As: Ouabagenin, g-Strophanthidin, Ouabain genin, KST-1B4642, 1,3,5,11,14,19-hexahydroxycard-20(22)-enolide
| Molecular Formula | C23H34O8 |
|---|---|
| Molecular Weight | 438.23 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 148.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 2 |
| Exact Mass | 438.22537 |
| Heavy Atoms | 31 |
| Complexity | 813.0 |
Chemical Identifiers
| CAS Number | 51222-26-5 |
|---|---|
| SMILES | CC12CC(C3C(C1(CCC2C4=CC(=O)OC4)O)CCC5(C3(C(CC(C5)O)O)CO)O)O |
| InChIKey | BXSABLKMKAINIU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Card-20(22)-enolide, 1,3,5,11,14,19-hexahydroxy-, (1beta,3beta,5beta,11alpha)- (CAS 51222-26-5), with molecular formula C23H34O8 and molecular weight 438.23 g/mol. IUPAC: 3-[1,3,5,11,14-pentahydroxy-10-(hydroxymethyl)-13-methyl-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2H-furan-5-one.
Chemical Property Profile of Card-20(22)-enolide, 1,3,5,11,14,19-hexahydroxy-, (1beta,3beta,5beta,11alpha)-
Property Insights of Card-20(22)-enolide, 1,3,5,11,14,19-hexahydroxy-, (1beta,3beta,5beta,11alpha)-
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Card-20(22)-enolide, 1,3,5,11,14,19-hexahydroxy-, (1beta,3beta,5beta,11alpha)-. The TPSA of 148.0 Ų indicates high polarity, suggesting Card-20(22)-enolide, 1,3,5,11,14,19-hexahydroxy-, (1beta,3beta,5beta,11alpha)- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Card-20(22)-enolide, 1,3,5,11,14,19-hexahydroxy-, (1beta,3beta,5beta,11alpha)- has 6 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Card-20(22)-enolide, 1,3,5,11,14,19-hexahydroxy-, (1beta,3beta,5beta,11alpha)-?
The CAS number of Card-20(22)-enolide, 1,3,5,11,14,19-hexahydroxy-, (1beta,3beta,5beta,11alpha)- is 51222-26-5.
What is the molecular formula of Card-20(22)-enolide, 1,3,5,11,14,19-hexahydroxy-, (1beta,3beta,5beta,11alpha)-?
The molecular formula of Card-20(22)-enolide, 1,3,5,11,14,19-hexahydroxy-, (1beta,3beta,5beta,11alpha)- is C23H34O8.
What is the molecular weight of Card-20(22)-enolide, 1,3,5,11,14,19-hexahydroxy-, (1beta,3beta,5beta,11alpha)-?
The molecular weight of Card-20(22)-enolide, 1,3,5,11,14,19-hexahydroxy-, (1beta,3beta,5beta,11alpha)- is 438.23 g/mol.
Where can I buy Card-20(22)-enolide, 1,3,5,11,14,19-hexahydroxy-, (1beta,3beta,5beta,11alpha)-?
You can request a quote for Card-20(22)-enolide, 1,3,5,11,14,19-hexahydroxy-, (1beta,3beta,5beta,11alpha)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Card-20(22)-enolide, 1,3,5,11,14,19-hexahydroxy-, (1beta,3beta,5beta,11alpha)-?
Yes, KEHONG BIO provides custom synthesis services for Card-20(22)-enolide, 1,3,5,11,14,19-hexahydroxy-, (1beta,3beta,5beta,11alpha)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.