N,O-Dimethyloxostephine
TL;DR: N,O-Dimethyloxostephine (CAS 99964-47-3) is a chemical compound with molecular formula C20H23NO7 and molecular weight 389.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(11R,15S,16S)-16-hydroxy-14,15-dimethoxy-20-methyl-5,7,21-trioxa-20-azahexacyclo[11.4.3.111,14.01,13.02,10.04,8]henicosa-2,4(8),9-trien-19-one
Also Known As: N,O-Dimethyloxostephine, (11R,15S,16S)-16-hydroxy-14,15-dimethoxy-20-methyl-5,7,21-trioxa-20-azahexacyclo[11.4.3.111,14.01,13.02,10.04,8]henicosa-2,4(8),9-trien-19-one, Hasubanan-16-one, 8,10-epoxy-6-hydroxy-7,8-dimethoxy-17-methyl-2,3-(methylenebis(oxy))-, (6beta,7beta,8beta,10beta)-
| Molecular Formula | C20H23NO7 |
|---|---|
| Molecular Weight | 389.15 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 86.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 389.14746 |
| Heavy Atoms | 28 |
| Complexity | 719.0 |
Chemical Identifiers
| CAS Number | 99964-47-3 |
|---|---|
| SMILES | CN1C(=O)CC23C14C[C@H](C5=CC6=C(C=C52)OCO6)OC4([C@H]([C@H](C3)O)OC)OC |
| InChIKey | PNGVVIBGSJGXTG-KUUHNABBSA-N |
Product Overview
N,O-Dimethyloxostephine (CAS 99964-47-3), with molecular formula C20H23NO7 and molecular weight 389.15 g/mol. IUPAC: (11R,15S,16S)-16-hydroxy-14,15-dimethoxy-20-methyl-5,7,21-trioxa-20-azahexacyclo[11.4.3.111,14.01,13.02,10.04,8]henicosa-2,4(8),9-trien-19-one.
Chemical Property Profile of N,O-Dimethyloxostephine
Property Insights of N,O-Dimethyloxostephine
The XLogP value of -0.3 indicates that N,O-Dimethyloxostephine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 86.7 Ų falls within the moderate polarity range, balancing permeability and solubility for N,O-Dimethyloxostephine. Following Lipinski's Rule of Five, N,O-Dimethyloxostephine has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N,O-Dimethyloxostephine?
The CAS number of N,O-Dimethyloxostephine is 99964-47-3.
What is the molecular formula of N,O-Dimethyloxostephine?
The molecular formula of N,O-Dimethyloxostephine is C20H23NO7.
What is the molecular weight of N,O-Dimethyloxostephine?
The molecular weight of N,O-Dimethyloxostephine is 389.15 g/mol.
Where can I buy N,O-Dimethyloxostephine?
You can request a quote for N,O-Dimethyloxostephine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,O-Dimethyloxostephine?
Yes, KEHONG BIO provides custom synthesis services for N,O-Dimethyloxostephine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.