Tetrahydrohistrionicotoxin
TL;DR: Tetrahydrohistrionicotoxin (CAS 55475-49-5) is a chemical compound with molecular formula C19H29NO and molecular weight 287.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,11S)-11-[(1E)-buta-1,3-dienyl]-2-[(2E)-penta-2,4-dienyl]-1-azaspiro[5.5]undecan-10-ol
Also Known As: Tetrahydrohistrionicotoxin, Histrionicotoxin, tetrahydro-, Tetrahydrohistrionicotoxin 287b, 1-Azaspiro(5.5)undecan-8-ol, 7-(1,3-butadienyl)-2-(2,4-pentadienyl)-, (6R-(6alpha(2S*(Z)),7beta(Z),8alpha))-, 7-(1,3-Butadienyl)-2-(2,4-pentadienyl)-1-azaspiro(5.5)undecan-8-ol (6R-(6alpha(2S*(Z)),7beta(Z),8alpha))-
| Molecular Formula | C19H29NO |
|---|---|
| Molecular Weight | 287.22 g/mol |
| LogP | 3.9028 |
| Topological Polar Surface Area | 32.26 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 287.2249 |
| Heavy Atoms | 21 |
| Complexity | 407.78943 |
Chemical Identifiers
| CAS Number | 55475-49-5 |
|---|---|
| SMILES | C=C/C=C/C[C@@H]1CCCC2(N1)CCCC([C@H]2/C=C/C=C)O |
Product Overview
Tetrahydrohistrionicotoxin (CAS 55475-49-5), with molecular formula C19H29NO and molecular weight 287.22 g/mol. IUPAC: (2S,11S)-11-[(1E)-buta-1,3-dienyl]-2-[(2E)-penta-2,4-dienyl]-1-azaspiro[5.5]undecan-10-ol.
Chemical Property Profile of Tetrahydrohistrionicotoxin
Property Insights of Tetrahydrohistrionicotoxin
The XLogP value of 3.9028 indicates that Tetrahydrohistrionicotoxin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.26 Ų, Tetrahydrohistrionicotoxin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tetrahydrohistrionicotoxin 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 Tetrahydrohistrionicotoxin?
The CAS number of Tetrahydrohistrionicotoxin is 55475-49-5.
What is the molecular formula of Tetrahydrohistrionicotoxin?
The molecular formula of Tetrahydrohistrionicotoxin is C19H29NO.
What is the molecular weight of Tetrahydrohistrionicotoxin?
The molecular weight of Tetrahydrohistrionicotoxin is 287.22 g/mol.
Where can I buy Tetrahydrohistrionicotoxin?
You can request a quote for Tetrahydrohistrionicotoxin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tetrahydrohistrionicotoxin?
Yes, KEHONG BIO provides custom synthesis services for Tetrahydrohistrionicotoxin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.