Tetrodonic acid
TL;DR: Tetrodonic acid (CAS 3270-35-7) is a chemical compound with molecular formula C11H17N3O8 and molecular weight 319.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Tetrodonic acid
9-amino-2,3,4,5-tetrahydroxy-4-(hydroxymethyl)-12-oxa-8,10-diazatricyclo[5.3.2.01,6]dodec-8-ene-11-carboxylic acid
Also Known As: Tetrodonic acid, 5,6,7,8-Tetrahydroxy-6-(hydroxymethyl)-2-iminooctahydro-1H-4,8a-(epoxymethano)quinazoline-9-carboxylic acid
| Molecular Formula | C11H17N3O8 |
|---|---|
| Molecular Weight | 319.10 g/mol |
| LogP | -4.8 |
| Topological Polar Surface Area | 198.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 2 |
| Exact Mass | 319.10156 |
| Heavy Atoms | 22 |
| Complexity | 543.0 |
Chemical Identifiers
| CAS Number | 3270-35-7 |
|---|---|
| SMILES | C(C1(C(C2C3N=C(NC2(C(C1O)O)C(O3)C(=O)O)N)O)O)O |
| InChIKey | MWPMJZZQPDXVJT-UHFFFAOYSA-N |
Product Overview
Tetrodonic acid (CAS 3270-35-7), with molecular formula C11H17N3O8 and molecular weight 319.10 g/mol. IUPAC: 9-amino-2,3,4,5-tetrahydroxy-4-(hydroxymethyl)-12-oxa-8,10-diazatricyclo[5.3.2.01,6]dodec-8-ene-11-carboxylic acid.
Chemical Property Profile of Tetrodonic acid
Property Insights of Tetrodonic acid
The XLogP value of -4.8 indicates that Tetrodonic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 198.0 Ų indicates high polarity, suggesting Tetrodonic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Tetrodonic acid has 8 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 Tetrodonic acid?
The CAS number of Tetrodonic acid is 3270-35-7.
What is the molecular formula of Tetrodonic acid?
The molecular formula of Tetrodonic acid is C11H17N3O8.
What is the molecular weight of Tetrodonic acid?
The molecular weight of Tetrodonic acid is 319.10 g/mol.
Where can I buy Tetrodonic acid?
You can request a quote for Tetrodonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tetrodonic acid?
Yes, KEHONG BIO provides custom synthesis services for Tetrodonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.