Allopumiliotoxin 267a
TL;DR: Allopumiliotoxin 267a (CAS 73376-38-2) is a chemical compound with molecular formula C16H29NO2 and molecular weight 267.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(7R,8R,8aS)-8-methyl-6-[(2R)-2-methylhexylidene]-1,2,3,5,7,8a-hexahydroindolizine-7,8-diol
Also Known As: Allopumiliotoxin 267a, NCI60_035562, 7,8-Indolizinediol, octahydro-8-methyl-6-((2R)-2-methylhexylidene)-, (6E,7R,8R,8aS)-, (6E,7R,8R,8aS)-8-methyl-6-[(2R)-2-methylhexylidene]-1,2,3,5,7,8a-hexahydroindolizine-7,8-diol, (7R,8R,8aS)-8-methyl-6-[(2R)-2-methylhexylidene]-1,2,3,5,7,8a-hexahydroindolizine-7,8-diol
| Molecular Formula | C16H29NO2 |
|---|---|
| Molecular Weight | 267.22 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 43.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 267.21982 |
| Heavy Atoms | 19 |
| Complexity | 342.0 |
Chemical Identifiers
| CAS Number | 73376-38-2 |
|---|---|
| SMILES | CCCC[C@@H](C)C=C1CN2CCC[C@H]2[C@@]([C@@H]1O)(C)O |
| InChIKey | LWXKAVPXEDNHLL-SLBVQIDZSA-N |
Product Overview
Allopumiliotoxin 267a (CAS 73376-38-2), with molecular formula C16H29NO2 and molecular weight 267.22 g/mol. IUPAC: (7R,8R,8aS)-8-methyl-6-[(2R)-2-methylhexylidene]-1,2,3,5,7,8a-hexahydroindolizine-7,8-diol.
Chemical Property Profile of Allopumiliotoxin 267a
Property Insights of Allopumiliotoxin 267a
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Allopumiliotoxin 267a. With a topological polar surface area (TPSA) of 43.7 Ų, Allopumiliotoxin 267a exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Allopumiliotoxin 267a has 2 hydrogen bond donor(s) and 3 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 267a?
The CAS number of Allopumiliotoxin 267a is 73376-38-2.
What is the molecular formula of Allopumiliotoxin 267a?
The molecular formula of Allopumiliotoxin 267a is C16H29NO2.
What is the molecular weight of Allopumiliotoxin 267a?
The molecular weight of Allopumiliotoxin 267a is 267.22 g/mol.
Where can I buy Allopumiliotoxin 267a?
You can request a quote for Allopumiliotoxin 267a directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Allopumiliotoxin 267a?
Yes, KEHONG BIO provides custom synthesis services for Allopumiliotoxin 267a and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.