Card-20(22)-enolide, 3-((2,2-dimethyl-1-oxopropoxy)methylaminoacetoxy)-14-hydroxy-
TL;DR: Card-20(22)-enolide, 3-((2,2-dimethyl-1-oxopropoxy)methylaminoacetoxy)-14-hydroxy- (CAS 81072-24-4) is a chemical compound with molecular formula C31H47NO7 and molecular weight 545.34 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[[2-[[(3S,5R,8R,9S,10S,13R,17R)-14-hydroxy-10,13-dimethyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]-2-oxoethyl]amino]methyl 2,2-dimethylpropanoate
Also Known As: Card-20(22)-enolide, 3-((2,2-dimethyl-1-oxopropoxy)methylaminoacetoxy)-14-hydroxy-, Acetic acid, iminodi-, tert butyl ester, ester with 3-beta,14-dihydroxy-5-beta-card-20(22)-enolide, 3-[(N-{[(2,2-Dimethylpropanoyl)oxy]methyl}glycyl)oxy]-14-hydroxycard-20(22)-enolide, (14xi)-3beta-[(N-{[(2,2-Dimethylpropanoyl)oxy]methyl}glycyl)oxy]-14-hydroxy-5beta-card-20(22)-enolide, [[2-[[(3S,5R,8R,9S,10S,13R,17R)-14-hydroxy-10,13-dimethyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]-2-oxoethyl]amino]methyl 2,2-dimethylpropanoate
| Molecular Formula | C31H47NO7 |
|---|---|
| Molecular Weight | 545.34 g/mol |
| LogP | 4.2916 |
| Topological Polar Surface Area | 111.16 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 545.33527 |
| Heavy Atoms | 39 |
| Complexity | 1032.4451 |
Chemical Identifiers
| CAS Number | 81072-24-4 |
|---|---|
| SMILES | C[C@]12CC[C@@H](C[C@H]1CC[C@@H]3[C@@H]2CC[C@]4(C3(CC[C@@H]4C5=CC(=O)OC5)O)C)OC(=O)CNCOC(=O)C(C)(C)C |
Product Overview
Card-20(22)-enolide, 3-((2,2-dimethyl-1-oxopropoxy)methylaminoacetoxy)-14-hydroxy- (CAS 81072-24-4), with molecular formula C31H47NO7 and molecular weight 545.34 g/mol. IUPAC: [[2-[[(3S,5R,8R,9S,10S,13R,17R)-14-hydroxy-10,13-dimethyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]-2-oxoethyl]amino]methyl 2,2-dimethylpropanoate.
Chemical Property Profile of Card-20(22)-enolide, 3-((2,2-dimethyl-1-oxopropoxy)methylaminoacetoxy)-14-hydroxy-
Property Insights of Card-20(22)-enolide, 3-((2,2-dimethyl-1-oxopropoxy)methylaminoacetoxy)-14-hydroxy-
The XLogP value of 4.2916 indicates that Card-20(22)-enolide, 3-((2,2-dimethyl-1-oxopropoxy)methylaminoacetoxy)-14-hydroxy- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.16 Ų falls within the moderate polarity range, balancing permeability and solubility for Card-20(22)-enolide, 3-((2,2-dimethyl-1-oxopropoxy)methylaminoacetoxy)-14-hydroxy-. Following Lipinski's Rule of Five, Card-20(22)-enolide, 3-((2,2-dimethyl-1-oxopropoxy)methylaminoacetoxy)-14-hydroxy- has 2 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, 3-((2,2-dimethyl-1-oxopropoxy)methylaminoacetoxy)-14-hydroxy-?
The CAS number of Card-20(22)-enolide, 3-((2,2-dimethyl-1-oxopropoxy)methylaminoacetoxy)-14-hydroxy- is 81072-24-4.
What is the molecular formula of Card-20(22)-enolide, 3-((2,2-dimethyl-1-oxopropoxy)methylaminoacetoxy)-14-hydroxy-?
The molecular formula of Card-20(22)-enolide, 3-((2,2-dimethyl-1-oxopropoxy)methylaminoacetoxy)-14-hydroxy- is C31H47NO7.
What is the molecular weight of Card-20(22)-enolide, 3-((2,2-dimethyl-1-oxopropoxy)methylaminoacetoxy)-14-hydroxy-?
The molecular weight of Card-20(22)-enolide, 3-((2,2-dimethyl-1-oxopropoxy)methylaminoacetoxy)-14-hydroxy- is 545.34 g/mol.
Where can I buy Card-20(22)-enolide, 3-((2,2-dimethyl-1-oxopropoxy)methylaminoacetoxy)-14-hydroxy-?
You can request a quote for Card-20(22)-enolide, 3-((2,2-dimethyl-1-oxopropoxy)methylaminoacetoxy)-14-hydroxy- 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, 3-((2,2-dimethyl-1-oxopropoxy)methylaminoacetoxy)-14-hydroxy-?
Yes, KEHONG BIO provides custom synthesis services for Card-20(22)-enolide, 3-((2,2-dimethyl-1-oxopropoxy)methylaminoacetoxy)-14-hydroxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.