3'-Acetyllycopsamine
TL;DR: 3'-Acetyllycopsamine (CAS 74243-01-9) is a chemical compound with molecular formula C17H27NO6 and molecular weight 341.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(7-acetyloxy-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl)methyl 2-hydroxy-2-(1-hydroxyethyl)-3-methylbutanoate
Also Known As: Acetyllycopsamine, 7-Acetyllycopsamine, 7-Acetylintermedine, 3'-Acetyllycopsamine, (7-acetyloxy-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl)methyl 2-hydroxy-2-(1-hydroxyethyl)-3-methylbutanoate
| Molecular Formula | C17H27NO6 |
|---|---|
| Molecular Weight | 341.18 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 96.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 341.18384 |
| Heavy Atoms | 24 |
| Complexity | 531.0 |
Chemical Identifiers
| CAS Number | 74243-01-9 |
|---|---|
| SMILES | CC(C)C(C(C)O)(C(=O)OCC1=CCN2C1C(CC2)OC(=O)C)O |
| InChIKey | RKDOFSJTBIDAHX-UHFFFAOYSA-N |
Product Overview
3'-Acetyllycopsamine (CAS 74243-01-9), with molecular formula C17H27NO6 and molecular weight 341.18 g/mol. IUPAC: (7-acetyloxy-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl)methyl 2-hydroxy-2-(1-hydroxyethyl)-3-methylbutanoate.
Chemical Property Profile of 3'-Acetyllycopsamine
Property Insights of 3'-Acetyllycopsamine
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3'-Acetyllycopsamine. The TPSA of 96.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3'-Acetyllycopsamine. Following Lipinski's Rule of Five, 3'-Acetyllycopsamine has 2 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 3'-Acetyllycopsamine?
The CAS number of 3'-Acetyllycopsamine is 74243-01-9.
What is the molecular formula of 3'-Acetyllycopsamine?
The molecular formula of 3'-Acetyllycopsamine is C17H27NO6.
What is the molecular weight of 3'-Acetyllycopsamine?
The molecular weight of 3'-Acetyllycopsamine is 341.18 g/mol.
Where can I buy 3'-Acetyllycopsamine?
You can request a quote for 3'-Acetyllycopsamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3'-Acetyllycopsamine?
Yes, KEHONG BIO provides custom synthesis services for 3'-Acetyllycopsamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.