Acovenoside A
TL;DR: Acovenoside A (CAS 663-95-6) is a chemical compound with molecular formula C30H46O9 and molecular weight 550.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(1R,3R,5R,10S,13R,14S,17R)-3-[(2S,5S)-3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl]oxy-1,14-dihydroxy-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: Acovenoside A, 4-18-00-02431 (Beilstein Handbook Reference), Card-20(22)-enolide, 3-((6-deoxy-3-O-methyl-alpha-L-talopyranosyl)oxy)-1,14-dihydroxy-, (1beta,3beta,5beta)-, (1beta,3beta,5beta)-3-((6-Deoxy-3-O-methyl-alpha-L-talopyranosyl)oxy)-1,14-dihydroxycard-20(22)-enolide, (1beta,3beta,5beta)-3-[(6-deoxy-3-O-methyl-alpha-L-talopyranosyl)oxy]-1,14-dihydroxycard-20(22)-enolide
| Molecular Formula | C30H46O9 |
|---|---|
| Molecular Weight | 550.31 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 135.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 550.3142 |
| Heavy Atoms | 39 |
| Complexity | 1000.0 |
Chemical Identifiers
| CAS Number | 663-95-6 |
|---|---|
| SMILES | CC1[C@@H](C(C([C@H](O1)O[C@@H]2C[C@H]3CCC4C([C@]3([C@@H](C2)O)C)CC[C@]5([C@@]4(CC[C@@H]5C6=CC(=O)OC6)O)C)O)OC)O |
| InChIKey | DKYDBQQIQAPGMH-INCJDWOASA-N |
Product Overview
Acovenoside A (CAS 663-95-6), with molecular formula C30H46O9 and molecular weight 550.31 g/mol. IUPAC: 3-[(1R,3R,5R,10S,13R,14S,17R)-3-[(2S,5S)-3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl]oxy-1,14-dihydroxy-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 Acovenoside A
Property Insights of Acovenoside A
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acovenoside A. The TPSA of 135.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Acovenoside A. Following Lipinski's Rule of Five, Acovenoside A has 4 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Acovenoside A?
The CAS number of Acovenoside A is 663-95-6.
What is the molecular formula of Acovenoside A?
The molecular formula of Acovenoside A is C30H46O9.
What is the molecular weight of Acovenoside A?
The molecular weight of Acovenoside A is 550.31 g/mol.
Where can I buy Acovenoside A?
You can request a quote for Acovenoside A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acovenoside A?
Yes, KEHONG BIO provides custom synthesis services for Acovenoside A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.