![(2R,3R,3aR,4aR,5S,6S,7S,8aR,9aR)-2-(6-Amino-9H-purin-9-yl)-3,4a,6-trihydroxy-5-(((E)-2-methylbut-2-enoyl)oxy)decahydrofuro[3,2-b]pyrano[2,3-e]pyran-7-carboxylic acid structure](/static/products/722/72283-62-6.png)
(2R,3R,3aR,4aR,5S,6S,7S,8aR,9aR)-2-(6-Amino-9H-purin-9-yl)-3,4a,6-trihydroxy-5-(((E)-2-methylbut-2-enoyl)oxy)decahydrofuro[3,2-b]pyrano[2,3-e]pyran-7-carboxylic acid
TL;DR: (2R,3R,3aR,4aR,5S,6S,7S,8aR,9aR)-2-(6-Amino-9H-purin-9-yl)-3,4a,6-trihydroxy-5-(((E)-2-methylbut-2-enoyl)oxy)decahydrofuro[3,2-b]pyrano[2,3-e]pyran-7-carboxylic acid (CAS 72283-62-6) is a chemical compound with molecular formula C21H25N5O10 and molecular weight 507.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,3R,4R,5R,7R,9R,11S,12S,13S)-5-(6-aminopurin-9-yl)-1,4,12-trihydroxy-13-[(E)-2-methylbut-2-enoyl]oxy-2,6,10-trioxatricyclo[7.4.0.03,7]tridecane-11-carboxylic acid
Also Known As: (2R,3R,3aR,4aR,5S,6S,7S,8aR,9aR)-2-(6-Amino-9H-purin-9-yl)-3,4a,6-trihydroxy-5-(((E)-2-methylbut-2-enoyl)oxy)decahydrofuro[3,2-b]pyrano[2,3-e]pyran-7-carboxylic acid, D-arabino-alpha-L-ido-7-Undeculo-7,3-pyranose-1,4-furanuronic acid,1-(6-amino-9H-purin-9-yl)-6,10-anhydro-1,5-dideoxy-, 8-((2E)-2-methyl-2-butenoate), (7R)-
| Molecular Formula | C21H25N5O10 |
|---|---|
| Molecular Weight | 507.16 g/mol |
| LogP | -1.7648 |
| Topological Polar Surface Area | 221.6 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 4 |
| Exact Mass | 507.16016 |
| Heavy Atoms | 36 |
| Complexity | 1234.8887 |
Chemical Identifiers
| CAS Number | 72283-62-6 |
|---|---|
| SMILES | C/C=C(\C)/C(=O)O[C@H]1[C@@H]([C@H](O[C@H]2[C@]1(O[C@H]3[C@@H](C2)O[C@H]([C@@H]3O)N4C=NC5=C(N=CN=C54)N)O)C(=O)O)O |
Product Overview
(2R,3R,3aR,4aR,5S,6S,7S,8aR,9aR)-2-(6-Amino-9H-purin-9-yl)-3,4a,6-trihydroxy-5-(((E)-2-methylbut-2-enoyl)oxy)decahydrofuro[3,2-b]pyrano[2,3-e]pyran-7-carboxylic acid (CAS 72283-62-6), with molecular formula C21H25N5O10 and molecular weight 507.16 g/mol. IUPAC: (1R,3R,4R,5R,7R,9R,11S,12S,13S)-5-(6-aminopurin-9-yl)-1,4,12-trihydroxy-13-[(E)-2-methylbut-2-enoyl]oxy-2,6,10-trioxatricyclo[7.4.0.03,7]tridecane-11-carboxylic acid.
Chemical Property Profile of (2R,3R,3aR,4aR,5S,6S,7S,8aR,9aR)-2-(6-Amino-9H-purin-9-yl)-3,4a,6-trihydroxy-5-(((E)-2-methylbut-2-enoyl)oxy)decahydrofuro[3,2-b]pyrano[2,3-e]pyran-7-carboxylic acid
Property Insights of (2R,3R,3aR,4aR,5S,6S,7S,8aR,9aR)-2-(6-Amino-9H-purin-9-yl)-3,4a,6-trihydroxy-5-(((E)-2-methylbut-2-enoyl)oxy)decahydrofuro[3,2-b]pyrano[2,3-e]pyran-7-carboxylic acid
The XLogP value of -1.7648 indicates that (2R,3R,3aR,4aR,5S,6S,7S,8aR,9aR)-2-(6-Amino-9H-purin-9-yl)-3,4a,6-trihydroxy-5-(((E)-2-methylbut-2-enoyl)oxy)decahydrofuro[3,2-b]pyrano[2,3-e]pyran-7-carboxylic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 221.6 Ų indicates high polarity, suggesting (2R,3R,3aR,4aR,5S,6S,7S,8aR,9aR)-2-(6-Amino-9H-purin-9-yl)-3,4a,6-trihydroxy-5-(((E)-2-methylbut-2-enoyl)oxy)decahydrofuro[3,2-b]pyrano[2,3-e]pyran-7-carboxylic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (2R,3R,3aR,4aR,5S,6S,7S,8aR,9aR)-2-(6-Amino-9H-purin-9-yl)-3,4a,6-trihydroxy-5-(((E)-2-methylbut-2-enoyl)oxy)decahydrofuro[3,2-b]pyrano[2,3-e]pyran-7-carboxylic acid has 5 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (2R,3R,3aR,4aR,5S,6S,7S,8aR,9aR)-2-(6-Amino-9H-purin-9-yl)-3,4a,6-trihydroxy-5-(((E)-2-methylbut-2-enoyl)oxy)decahydrofuro[3,2-b]pyrano[2,3-e]pyran-7-carboxylic acid?
The CAS number of (2R,3R,3aR,4aR,5S,6S,7S,8aR,9aR)-2-(6-Amino-9H-purin-9-yl)-3,4a,6-trihydroxy-5-(((E)-2-methylbut-2-enoyl)oxy)decahydrofuro[3,2-b]pyrano[2,3-e]pyran-7-carboxylic acid is 72283-62-6.
What is the molecular formula of (2R,3R,3aR,4aR,5S,6S,7S,8aR,9aR)-2-(6-Amino-9H-purin-9-yl)-3,4a,6-trihydroxy-5-(((E)-2-methylbut-2-enoyl)oxy)decahydrofuro[3,2-b]pyrano[2,3-e]pyran-7-carboxylic acid?
The molecular formula of (2R,3R,3aR,4aR,5S,6S,7S,8aR,9aR)-2-(6-Amino-9H-purin-9-yl)-3,4a,6-trihydroxy-5-(((E)-2-methylbut-2-enoyl)oxy)decahydrofuro[3,2-b]pyrano[2,3-e]pyran-7-carboxylic acid is C21H25N5O10.
What is the molecular weight of (2R,3R,3aR,4aR,5S,6S,7S,8aR,9aR)-2-(6-Amino-9H-purin-9-yl)-3,4a,6-trihydroxy-5-(((E)-2-methylbut-2-enoyl)oxy)decahydrofuro[3,2-b]pyrano[2,3-e]pyran-7-carboxylic acid?
The molecular weight of (2R,3R,3aR,4aR,5S,6S,7S,8aR,9aR)-2-(6-Amino-9H-purin-9-yl)-3,4a,6-trihydroxy-5-(((E)-2-methylbut-2-enoyl)oxy)decahydrofuro[3,2-b]pyrano[2,3-e]pyran-7-carboxylic acid is 507.16 g/mol.
Where can I buy (2R,3R,3aR,4aR,5S,6S,7S,8aR,9aR)-2-(6-Amino-9H-purin-9-yl)-3,4a,6-trihydroxy-5-(((E)-2-methylbut-2-enoyl)oxy)decahydrofuro[3,2-b]pyrano[2,3-e]pyran-7-carboxylic acid?
You can request a quote for (2R,3R,3aR,4aR,5S,6S,7S,8aR,9aR)-2-(6-Amino-9H-purin-9-yl)-3,4a,6-trihydroxy-5-(((E)-2-methylbut-2-enoyl)oxy)decahydrofuro[3,2-b]pyrano[2,3-e]pyran-7-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2R,3R,3aR,4aR,5S,6S,7S,8aR,9aR)-2-(6-Amino-9H-purin-9-yl)-3,4a,6-trihydroxy-5-(((E)-2-methylbut-2-enoyl)oxy)decahydrofuro[3,2-b]pyrano[2,3-e]pyran-7-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for (2R,3R,3aR,4aR,5S,6S,7S,8aR,9aR)-2-(6-Amino-9H-purin-9-yl)-3,4a,6-trihydroxy-5-(((E)-2-methylbut-2-enoyl)oxy)decahydrofuro[3,2-b]pyrano[2,3-e]pyran-7-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.