Tetrodotoxin, 11-((carboxymethyl)amino)-11-deoxy-, labeled with tritium
TL;DR: Tetrodotoxin, 11-((carboxymethyl)amino)-11-deoxy-, labeled with tritium (CAS 73600-90-5) is a chemical compound with molecular formula C13H20N4O9 and molecular weight 376.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3-amino-5,9,12,13,14-pentahydroxy-8,10-dioxa-2,4-diazatetracyclo[7.3.1.17,11.01,6]tetradec-3-en-14-yl)methylamino]acetic acid
Also Known As: Tetrodotoxin, 11-((carboxymethyl)amino)-11-deoxy-, labeled with tritium
| Molecular Formula | C13H20N4O9 |
|---|---|
| Molecular Weight | 376.12 g/mol |
| LogP | -8.4 |
| Topological Polar Surface Area | 219.0 Ų |
| Hydrogen Bond Donors | 9 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 4 |
| Exact Mass | 376.12302 |
| Heavy Atoms | 26 |
| Complexity | 678.0 |
Chemical Identifiers
| CAS Number | 73600-90-5 |
|---|---|
| SMILES | C(C(=O)O)NCC1(C2C3C(N=C(NC34C(C1OC(C4O)(O2)O)O)N)O)O |
| InChIKey | RSCVPTMBAMYFEH-UHFFFAOYSA-N |
Product Overview
Tetrodotoxin, 11-((carboxymethyl)amino)-11-deoxy-, labeled with tritium (CAS 73600-90-5), with molecular formula C13H20N4O9 and molecular weight 376.12 g/mol. IUPAC: 2-[(3-amino-5,9,12,13,14-pentahydroxy-8,10-dioxa-2,4-diazatetracyclo[7.3.1.17,11.01,6]tetradec-3-en-14-yl)methylamino]acetic acid.
Chemical Property Profile of Tetrodotoxin, 11-((carboxymethyl)amino)-11-deoxy-, labeled with tritium
Property Insights of Tetrodotoxin, 11-((carboxymethyl)amino)-11-deoxy-, labeled with tritium
The XLogP value of -8.4 indicates that Tetrodotoxin, 11-((carboxymethyl)amino)-11-deoxy-, labeled with tritium is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 219.0 Ų indicates high polarity, suggesting Tetrodotoxin, 11-((carboxymethyl)amino)-11-deoxy-, labeled with tritium may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Tetrodotoxin, 11-((carboxymethyl)amino)-11-deoxy-, labeled with tritium has 9 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Tetrodotoxin, 11-((carboxymethyl)amino)-11-deoxy-, labeled with tritium?
The CAS number of Tetrodotoxin, 11-((carboxymethyl)amino)-11-deoxy-, labeled with tritium is 73600-90-5.
What is the molecular formula of Tetrodotoxin, 11-((carboxymethyl)amino)-11-deoxy-, labeled with tritium?
The molecular formula of Tetrodotoxin, 11-((carboxymethyl)amino)-11-deoxy-, labeled with tritium is C13H20N4O9.
What is the molecular weight of Tetrodotoxin, 11-((carboxymethyl)amino)-11-deoxy-, labeled with tritium?
The molecular weight of Tetrodotoxin, 11-((carboxymethyl)amino)-11-deoxy-, labeled with tritium is 376.12 g/mol.
Where can I buy Tetrodotoxin, 11-((carboxymethyl)amino)-11-deoxy-, labeled with tritium?
You can request a quote for Tetrodotoxin, 11-((carboxymethyl)amino)-11-deoxy-, labeled with tritium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tetrodotoxin, 11-((carboxymethyl)amino)-11-deoxy-, labeled with tritium?
Yes, KEHONG BIO provides custom synthesis services for Tetrodotoxin, 11-((carboxymethyl)amino)-11-deoxy-, labeled with tritium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.