4'-O-(b-D-2",3",4",6"-Tetraacetyl-glucopyranosyl)-4-nitrophloretin
TL;DR: 4'-O-(b-D-2",3",4",6"-Tetraacetyl-glucopyranosyl)-4-nitrophloretin (CAS 82628-87-3) is a chemical compound with molecular formula C29H31NO15 and molecular weight 633.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3,4,5-triacetyloxy-6-[3,5-dihydroxy-4-[3-(4-nitrophenyl)propanoyl]phenoxy]oxan-2-yl]methyl acetate
Also Known As: 4'-O-(b-D-2",3",4",6"-Tetraacetyl-glucopyranosyl)-4-nitrophloretin, [3,4,5-triacetyloxy-6-[3,5-dihydroxy-4-[3-(4-nitrophenyl)propanoyl]phenoxy]oxan-2-yl]methyl acetate
| Molecular Formula | C29H31NO15 |
|---|---|
| Molecular Weight | 633.17 g/mol |
| LogP | 2.2834 |
| Topological Polar Surface Area | 224.33 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 12 |
| Exact Mass | 633.1694 |
| Heavy Atoms | 45 |
| Complexity | 1431.0773 |
Chemical Identifiers
| CAS Number | 82628-87-3 |
|---|---|
| SMILES | CC(=O)OCC1C(C(C(C(O1)OC2=CC(=C(C(=C2)O)C(=O)CCC3=CC=C(C=C3)[N+](=O)[O-])O)OC(=O)C)OC(=O)C)OC(=O)C |
Product Overview
4'-O-(b-D-2",3",4",6"-Tetraacetyl-glucopyranosyl)-4-nitrophloretin (CAS 82628-87-3), with molecular formula C29H31NO15 and molecular weight 633.17 g/mol. IUPAC: [3,4,5-triacetyloxy-6-[3,5-dihydroxy-4-[3-(4-nitrophenyl)propanoyl]phenoxy]oxan-2-yl]methyl acetate.
Chemical Property Profile of 4'-O-(b-D-2",3",4",6"-Tetraacetyl-glucopyranosyl)-4-nitrophloretin
Property Insights of 4'-O-(b-D-2",3",4",6"-Tetraacetyl-glucopyranosyl)-4-nitrophloretin
The XLogP value of 2.2834 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4'-O-(b-D-2",3",4",6"-Tetraacetyl-glucopyranosyl)-4-nitrophloretin. The TPSA of 224.33 Ų indicates high polarity, suggesting 4'-O-(b-D-2",3",4",6"-Tetraacetyl-glucopyranosyl)-4-nitrophloretin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4'-O-(b-D-2",3",4",6"-Tetraacetyl-glucopyranosyl)-4-nitrophloretin has 2 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4'-O-(b-D-2",3",4",6"-Tetraacetyl-glucopyranosyl)-4-nitrophloretin?
The CAS number of 4'-O-(b-D-2",3",4",6"-Tetraacetyl-glucopyranosyl)-4-nitrophloretin is 82628-87-3.
What is the molecular formula of 4'-O-(b-D-2",3",4",6"-Tetraacetyl-glucopyranosyl)-4-nitrophloretin?
The molecular formula of 4'-O-(b-D-2",3",4",6"-Tetraacetyl-glucopyranosyl)-4-nitrophloretin is C29H31NO15.
What is the molecular weight of 4'-O-(b-D-2",3",4",6"-Tetraacetyl-glucopyranosyl)-4-nitrophloretin?
The molecular weight of 4'-O-(b-D-2",3",4",6"-Tetraacetyl-glucopyranosyl)-4-nitrophloretin is 633.17 g/mol.
Where can I buy 4'-O-(b-D-2",3",4",6"-Tetraacetyl-glucopyranosyl)-4-nitrophloretin?
You can request a quote for 4'-O-(b-D-2",3",4",6"-Tetraacetyl-glucopyranosyl)-4-nitrophloretin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4'-O-(b-D-2",3",4",6"-Tetraacetyl-glucopyranosyl)-4-nitrophloretin?
Yes, KEHONG BIO provides custom synthesis services for 4'-O-(b-D-2",3",4",6"-Tetraacetyl-glucopyranosyl)-4-nitrophloretin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.