Histrionicotoxin
TL;DR: Histrionicotoxin (CAS 34272-51-0) is a chemical compound with molecular formula C19H25NO and molecular weight 283.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,6R,10S,11S)-11-[(E)-but-1-en-3-ynyl]-2-[(E)-pent-2-en-4-ynyl]-1-azaspiro[5.5]undecan-10-ol
Also Known As: Histrionicotoxin, histrionicotoxin 283A, (2S,6R,10S,11S)-11-[(E)-but-1-en-3-ynyl]-2-[(E)-pent-2-en-4-ynyl]-1-azaspiro[5.5]undecan-10-ol, (2S,6R,7S,8S)-7-[(1E)-but-1-en-3-yn-1-yl]-2-[(2E)-pent-2-en-4-yn-1-yl]-1-azaspiro[5.5]undecan-8-ol, (4S,6R,10S,11S)-11-[(E)-but-1-en-3-ynyl]-4-[(E)-pent-2-en-4-ynyl]-5-azaspiro[5.5]undecan-10-ol
| Molecular Formula | C19H25NO |
|---|---|
| Molecular Weight | 283.19 g/mol |
| LogP | 2.7972 |
| Topological Polar Surface Area | 32.26 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 283.1936 |
| Heavy Atoms | 21 |
| Complexity | 474.77527 |
Chemical Identifiers
| CAS Number | 34272-51-0 |
|---|---|
| SMILES | C#C/C=C/C[C@@H]1CCC[C@@]2(N1)CCC[C@@H]([C@H]2/C=C/C#C)O |
Product Overview
Histrionicotoxin (CAS 34272-51-0), with molecular formula C19H25NO and molecular weight 283.19 g/mol. IUPAC: (2S,6R,10S,11S)-11-[(E)-but-1-en-3-ynyl]-2-[(E)-pent-2-en-4-ynyl]-1-azaspiro[5.5]undecan-10-ol.
Chemical Property Profile of Histrionicotoxin
Property Insights of Histrionicotoxin
The XLogP value of 2.7972 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Histrionicotoxin. With a topological polar surface area (TPSA) of 32.26 Ų, Histrionicotoxin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Histrionicotoxin has 2 hydrogen bond donor(s) and 2 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 Histrionicotoxin?
The CAS number of Histrionicotoxin is 34272-51-0.
What is the molecular formula of Histrionicotoxin?
The molecular formula of Histrionicotoxin is C19H25NO.
What is the molecular weight of Histrionicotoxin?
The molecular weight of Histrionicotoxin is 283.19 g/mol.
Where can I buy Histrionicotoxin?
You can request a quote for Histrionicotoxin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Histrionicotoxin?
Yes, KEHONG BIO provides custom synthesis services for Histrionicotoxin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.