Stemonidine
TL;DR: Stemonidine (CAS 66267-46-7) is a chemical compound with molecular formula C19H29NO5 and molecular weight 351.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-methoxy-3'-methyl-3-(4-methyl-5-oxooxolan-2-yl)spiro[1,2,3,5,6,7,8,9a-octahydropyrrolo[1,2-a]azepine-9,5'-oxolane]-2'-one
Also Known As: Stemonidine, stemospironine, (2R)-Stemonidine, 8-methoxy-3'-methyl-3-(4-methyl-5-oxooxolan-2-yl)spiro[1,2,3,5,6,7,8,9a-octahydropyrrolo[1,2-a]azepine-9,5'-oxolane]-2'-one, (3S,3'R,8R,9R,9As)-8-methoxy-3'-methyl-3-[(2S,4S)-4-methyl-5-oxooxolan-2-yl]spiro[1,2,3,5,6,7,8,9a-octahydropyrrolo[1,2-a]azepine-9,5'-oxolane]-2'-one
| Molecular Formula | C19H29NO5 |
|---|---|
| Molecular Weight | 351.20 g/mol |
| LogP | 1.9016 |
| Topological Polar Surface Area | 65.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 351.20456 |
| Heavy Atoms | 25 |
| Complexity | 566.0177 |
Chemical Identifiers
| CAS Number | 66267-46-7 |
|---|---|
| SMILES | CC1CC(OC1=O)C2CCC3N2CCCC(C34CC(C(=O)O4)C)OC |
Product Overview
Stemonidine (CAS 66267-46-7), with molecular formula C19H29NO5 and molecular weight 351.20 g/mol. IUPAC: 8-methoxy-3'-methyl-3-(4-methyl-5-oxooxolan-2-yl)spiro[1,2,3,5,6,7,8,9a-octahydropyrrolo[1,2-a]azepine-9,5'-oxolane]-2'-one.
Chemical Property Profile of Stemonidine
Property Insights of Stemonidine
The XLogP value of 1.9016 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Stemonidine. The TPSA of 65.07 Ų falls within the moderate polarity range, balancing permeability and solubility for Stemonidine. Following Lipinski's Rule of Five, Stemonidine has 0 hydrogen bond donor(s) and 6 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 Stemonidine?
The CAS number of Stemonidine is 66267-46-7.
What is the molecular formula of Stemonidine?
The molecular formula of Stemonidine is C19H29NO5.
What is the molecular weight of Stemonidine?
The molecular weight of Stemonidine is 351.20 g/mol.
Where can I buy Stemonidine?
You can request a quote for Stemonidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Stemonidine?
Yes, KEHONG BIO provides custom synthesis services for Stemonidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.