Allopumiliotoxin 323B'
TL;DR: Allopumiliotoxin 323B' (CAS 109279-26-7) is a chemical compound with molecular formula C19H33NO3 and molecular weight 323.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6E,7R,8R,8aS)-6-[(E,6S)-6-hydroxy-2,5-dimethyloct-4-enylidene]-8-methyl-1,2,3,5,7,8a-hexahydroindolizine-7,8-diol
Also Known As: Allopumiliotoxin 323B', Allopumiliotoxin 323b, Allo-PTX 323B', allo-pumiliotoxin 323B', (6E,7R,8R,8aS)-6-[(E,6S)-6-hydroxy-2,5-dimethyloct-4-enylidene]-8-methyl-1,2,3,5,7,8a-hexahydroindolizine-7,8-diol
| Molecular Formula | C19H33NO3 |
|---|---|
| Molecular Weight | 323.25 g/mol |
| LogP | 2.2461 |
| Topological Polar Surface Area | 63.93 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 323.24603 |
| Heavy Atoms | 23 |
| Complexity | 469.23517 |
Chemical Identifiers
| CAS Number | 109279-26-7 |
|---|---|
| SMILES | CC[C@@H](/C(=C/CC(C)/C=C/1\CN2CCC[C@H]2[C@@]([C@@H]1O)(C)O)/C)O |
Product Overview
Allopumiliotoxin 323B' (CAS 109279-26-7), with molecular formula C19H33NO3 and molecular weight 323.25 g/mol. IUPAC: (6E,7R,8R,8aS)-6-[(E,6S)-6-hydroxy-2,5-dimethyloct-4-enylidene]-8-methyl-1,2,3,5,7,8a-hexahydroindolizine-7,8-diol.
Chemical Property Profile of Allopumiliotoxin 323B'
Property Insights of Allopumiliotoxin 323B'
The XLogP value of 2.2461 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Allopumiliotoxin 323B'. The TPSA of 63.93 Ų falls within the moderate polarity range, balancing permeability and solubility for Allopumiliotoxin 323B'. Following Lipinski's Rule of Five, Allopumiliotoxin 323B' has 3 hydrogen bond donor(s) and 4 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 Allopumiliotoxin 323B'?
The CAS number of Allopumiliotoxin 323B' is 109279-26-7.
What is the molecular formula of Allopumiliotoxin 323B'?
The molecular formula of Allopumiliotoxin 323B' is C19H33NO3.
What is the molecular weight of Allopumiliotoxin 323B'?
The molecular weight of Allopumiliotoxin 323B' is 323.25 g/mol.
Where can I buy Allopumiliotoxin 323B'?
You can request a quote for Allopumiliotoxin 323B' directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Allopumiliotoxin 323B'?
Yes, KEHONG BIO provides custom synthesis services for Allopumiliotoxin 323B' and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.