毛果天芥菜碱
TL;DR: 毛果天芥菜碱 (CAS 303-34-4) is a chemical compound with molecular formula C21H33NO7 and molecular weight 411.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
毛果天芥菜碱
[(7S,8R)-7-(2-methylbut-2-enoyloxy)-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl]methyl (2R)-2,3-dihydroxy-2-[(1R)-1-methoxyethyl]-3-methylbutanoate
Also Known As: LASIOCARPINE
| Molecular Formula | C21H33NO7 |
|---|---|
| Molecular Weight | 411.23 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 106.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 411.2257 |
| Heavy Atoms | 29 |
| Complexity | 699.0 |
Chemical Identifiers
| CAS Number | 303-34-4 |
|---|---|
| SMILES | CC=C(C)C(=O)O[C@H]1CCN2[C@@H]1C(=CC2)COC(=O)[C@@]([C@@H](C)OC)(C(C)(C)O)O |
| InChIKey | QHOZSLCIKHUPSU-GAYYXQCQSA-N |
Product Overview
毛果天芥菜碱 (CAS 303-34-4), with molecular formula C21H33NO7 and molecular weight 411.23 g/mol. IUPAC: [(7S,8R)-7-(2-methylbut-2-enoyloxy)-5,6,7,8-tetrahydro-3H-pyrrolizin-1-yl]methyl (2R)-2,3-dihydroxy-2-[(1R)-1-methoxyethyl]-3-methylbutanoate.
Chemical Property Profile of 毛果天芥菜碱
Property Insights of 毛果天芥菜碱
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 毛果天芥菜碱. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 毛果天芥菜碱. Following Lipinski's Rule of Five, 毛果天芥菜碱 has 2 hydrogen bond donor(s) and 8 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 毛果天芥菜碱?
The CAS number of 毛果天芥菜碱 is 303-34-4.
What is the molecular formula of 毛果天芥菜碱?
The molecular formula of 毛果天芥菜碱 is C21H33NO7.
What is the molecular weight of 毛果天芥菜碱?
The molecular weight of 毛果天芥菜碱 is 411.23 g/mol.
Where can I buy 毛果天芥菜碱?
You can request a quote for 毛果天芥菜碱 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 毛果天芥菜碱?
Yes, KEHONG BIO provides custom synthesis services for 毛果天芥菜碱 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.