Butirosina
TL;DR: Butirosina (CAS 12772-35-9) is a chemical compound with molecular formula C21H41N5O12 and molecular weight 555.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R)-4-amino-N-[(1R,2S,3R,4R,5S)-5-amino-4-[(2R,3R,4R,5S,6R)-3-amino-6-(aminomethyl)-4,5-dihydroxyoxan-2-yl]oxy-3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-2-hydroxycyclohexyl]-2-hydroxybutanamide
Also Known As: Butirosina, Ambutyrosin, Butirosin, Butirosine, Butirosinum
| Molecular Formula | C21H41N5O12 |
|---|---|
| Molecular Weight | 555.28 g/mol |
| LogP | -7.3 |
| Topological Polar Surface Area | 312.0 Ų |
| Hydrogen Bond Donors | 12 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 10 |
| Exact Mass | 555.27515 |
| Heavy Atoms | 38 |
| Complexity | 772.0 |
Chemical Identifiers
| CAS Number | 12772-35-9 |
|---|---|
| SMILES | C1[C@@H]([C@H]([C@@H]([C@H]([C@@H]1NC(=O)[C@@H](CCN)O)O)O[C@@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O)O[C@@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CN)O)O)N)N |
| InChIKey | XEQLFNPSYWZPOW-NUOYRARPSA-N |
Product Overview
Butirosina (CAS 12772-35-9), with molecular formula C21H41N5O12 and molecular weight 555.28 g/mol. IUPAC: (2R)-4-amino-N-[(1R,2S,3R,4R,5S)-5-amino-4-[(2R,3R,4R,5S,6R)-3-amino-6-(aminomethyl)-4,5-dihydroxyoxan-2-yl]oxy-3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-2-hydroxycyclohexyl]-2-hydroxybutanamide.
Chemical Property Profile of Butirosina
Property Insights of Butirosina
The XLogP value of -7.3 indicates that Butirosina is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 312.0 Ų indicates high polarity, suggesting Butirosina may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Butirosina has 12 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Butirosina?
The CAS number of Butirosina is 12772-35-9.
What is the molecular formula of Butirosina?
The molecular formula of Butirosina is C21H41N5O12.
What is the molecular weight of Butirosina?
The molecular weight of Butirosina is 555.28 g/mol.
Where can I buy Butirosina?
You can request a quote for Butirosina directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butirosina?
Yes, KEHONG BIO provides custom synthesis services for Butirosina and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.