Assamicadine
TL;DR: Assamicadine (CAS 126260-96-6) is a chemical compound with molecular formula C16H23NO5 and molecular weight 309.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(7-hydroxy-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl)methyl 2,3,4-trimethyl-5-oxooxolane-3-carboxylate
Also Known As: Assamicadine, (-)-Assamicadine, (7-hydroxy-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl)methyl 2,3,4-trimethyl-5-oxooxolane-3-carboxylate, (1-Hydroxy-2,3,5,7a-tetrahydro-1H-pyrrolizin-7-yl)methyl 2,3,4-trimethyl-5-oxooxolane-3-carboxylate, (1-Hydroxy-2,3,5,7a-tetrahydro-1H-pyrrolizin-7-yl)methyl 2,3,4-trimethyl-5-oxotetrahydrofuran-3-carboxylate
| Molecular Formula | C16H23NO5 |
|---|---|
| Molecular Weight | 309.16 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 76.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 309.15762 |
| Heavy Atoms | 22 |
| Complexity | 531.0 |
Chemical Identifiers
| CAS Number | 126260-96-6 |
|---|---|
| SMILES | CC1C(=O)OC(C1(C)C(=O)OCC2=CCN3C2C(CC3)O)C |
| InChIKey | ZUGXHQOKJKNPFK-UHFFFAOYSA-N |
Product Overview
Assamicadine (CAS 126260-96-6), with molecular formula C16H23NO5 and molecular weight 309.16 g/mol. IUPAC: (7-hydroxy-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl)methyl 2,3,4-trimethyl-5-oxooxolane-3-carboxylate.
Chemical Property Profile of Assamicadine
Property Insights of Assamicadine
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Assamicadine. The TPSA of 76.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Assamicadine. Following Lipinski's Rule of Five, Assamicadine has 1 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 Assamicadine?
The CAS number of Assamicadine is 126260-96-6.
What is the molecular formula of Assamicadine?
The molecular formula of Assamicadine is C16H23NO5.
What is the molecular weight of Assamicadine?
The molecular weight of Assamicadine is 309.16 g/mol.
Where can I buy Assamicadine?
You can request a quote for Assamicadine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Assamicadine?
Yes, KEHONG BIO provides custom synthesis services for Assamicadine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.