Tetrodotoxin, 11-deoxy-11-oxo-
TL;DR: Tetrodotoxin, 11-deoxy-11-oxo- (CAS 73600-89-2) is a chemical compound with molecular formula C11H15N3O8 and molecular weight 317.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-5,9,12,13,14-pentahydroxy-8,10-dioxa-2,4-diazatetracyclo[7.3.1.17,11.01,6]tetradec-3-ene-14-carbaldehyde
Also Known As: Tetrodotoxin, 11-deoxy-11-oxo-
| Molecular Formula | C11H15N3O8 |
|---|---|
| Molecular Weight | 317.09 g/mol |
| LogP | -5.7 |
| Topological Polar Surface Area | 187.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 1 |
| Exact Mass | 317.0859 |
| Heavy Atoms | 22 |
| Complexity | 588.0 |
Chemical Identifiers
| CAS Number | 73600-89-2 |
|---|---|
| SMILES | C(=O)C1(C2C3C(N=C(NC34C(C1OC(C4O)(O2)O)O)N)O)O |
| InChIKey | AWPSOPFZRFNJNJ-UHFFFAOYSA-N |
Product Overview
Tetrodotoxin, 11-deoxy-11-oxo- (CAS 73600-89-2), with molecular formula C11H15N3O8 and molecular weight 317.09 g/mol. IUPAC: 3-amino-5,9,12,13,14-pentahydroxy-8,10-dioxa-2,4-diazatetracyclo[7.3.1.17,11.01,6]tetradec-3-ene-14-carbaldehyde.
Chemical Property Profile of Tetrodotoxin, 11-deoxy-11-oxo-
Property Insights of Tetrodotoxin, 11-deoxy-11-oxo-
The XLogP value of -5.7 indicates that Tetrodotoxin, 11-deoxy-11-oxo- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 187.0 Ų indicates high polarity, suggesting Tetrodotoxin, 11-deoxy-11-oxo- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Tetrodotoxin, 11-deoxy-11-oxo- has 7 hydrogen bond donor(s) and 9 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-deoxy-11-oxo-?
The CAS number of Tetrodotoxin, 11-deoxy-11-oxo- is 73600-89-2.
What is the molecular formula of Tetrodotoxin, 11-deoxy-11-oxo-?
The molecular formula of Tetrodotoxin, 11-deoxy-11-oxo- is C11H15N3O8.
What is the molecular weight of Tetrodotoxin, 11-deoxy-11-oxo-?
The molecular weight of Tetrodotoxin, 11-deoxy-11-oxo- is 317.09 g/mol.
Where can I buy Tetrodotoxin, 11-deoxy-11-oxo-?
You can request a quote for Tetrodotoxin, 11-deoxy-11-oxo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tetrodotoxin, 11-deoxy-11-oxo-?
Yes, KEHONG BIO provides custom synthesis services for Tetrodotoxin, 11-deoxy-11-oxo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.