deacetylravidomycin N-oxide
TL;DR: deacetylravidomycin N-oxide (CAS 114494-30-3) is a chemical compound with molecular formula C31H33NO10 and molecular weight 579.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3R,4R,5R,6R)-5-acetyloxy-2-(8-ethenyl-1-hydroxy-10,12-dimethoxy-6-oxonaphtho[1,2-c]isochromen-4-yl)-3-hydroxy-N,N,6-trimethyloxan-4-amine oxide
Also Known As: Ravidomycin N-oxide, Deacetylravidomycin N-oxide, Desacetylravidomycin N-oxide, HY-N14959, J2.390.657K
| Molecular Formula | C31H33NO10 |
|---|---|
| Molecular Weight | 579.21 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 139.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 579.21045 |
| Heavy Atoms | 42 |
| Complexity | 1020.0 |
Chemical Identifiers
| CAS Number | 114494-30-3 |
|---|---|
| SMILES | C[C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)C2=C3C(=C(C=C2)O)C(=CC4=C3OC(=O)C5=C4C(=CC(=C5)C=C)OC)OC)O)[N+](C)(C)[O-])OC(=O)C |
| InChIKey | JDRNEUMZVBWRJJ-LSXWJJIVSA-N |
Product Overview
deacetylravidomycin N-oxide (CAS 114494-30-3), with molecular formula C31H33NO10 and molecular weight 579.21 g/mol. IUPAC: (2S,3R,4R,5R,6R)-5-acetyloxy-2-(8-ethenyl-1-hydroxy-10,12-dimethoxy-6-oxonaphtho[1,2-c]isochromen-4-yl)-3-hydroxy-N,N,6-trimethyloxan-4-amine oxide.
Chemical Property Profile of deacetylravidomycin N-oxide
Property Insights of deacetylravidomycin N-oxide
The XLogP value of 4.0 indicates that deacetylravidomycin N-oxide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 139.0 Ų falls within the moderate polarity range, balancing permeability and solubility for deacetylravidomycin N-oxide. Following Lipinski's Rule of Five, deacetylravidomycin N-oxide has 2 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of deacetylravidomycin N-oxide?
The CAS number of deacetylravidomycin N-oxide is 114494-30-3.
What is the molecular formula of deacetylravidomycin N-oxide?
The molecular formula of deacetylravidomycin N-oxide is C31H33NO10.
What is the molecular weight of deacetylravidomycin N-oxide?
The molecular weight of deacetylravidomycin N-oxide is 579.21 g/mol.
Where can I buy deacetylravidomycin N-oxide?
You can request a quote for deacetylravidomycin N-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for deacetylravidomycin N-oxide?
Yes, KEHONG BIO provides custom synthesis services for deacetylravidomycin N-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.