Butikacin
TL;DR: Butikacin (CAS 59733-86-7) is a chemical compound with molecular formula C22H45N5O12 and molecular weight 571.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[6-amino-3-[4-amino-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-[(4-amino-2-hydroxybutyl)amino]-2-hydroxycyclohexyl]oxy-6-(aminomethyl)oxane-3,4,5-triol
Also Known As: Butikacin, (1S,2S,3R,4S,6R)-4-Amino-3-[(6-amino-6-deoxy-alpha-D-glucopyrano, 2-[6-amino-3-[4-amino-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-[(4-amino-2-hydroxybutyl)amino]-2-hydroxycyclohexyl]oxy-6-(aminomethyl)oxane-3,4,5-triol
| Molecular Formula | C22H45N5O12 |
|---|---|
| Molecular Weight | 571.31 g/mol |
| LogP | -7.6 |
| Topological Polar Surface Area | 315.0 Ų |
| Hydrogen Bond Donors | 13 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 11 |
| Exact Mass | 571.30646 |
| Heavy Atoms | 39 |
| Complexity | 748.0 |
Chemical Identifiers
| CAS Number | 59733-86-7 |
|---|---|
| SMILES | C1C(C(C(C(C1NCC(CCN)O)OC2C(C(C(C(O2)CO)O)N)O)O)OC3C(C(C(C(O3)CN)O)O)O)N |
| InChIKey | OCFOTEIMZBKQFS-UHFFFAOYSA-N |
Product Overview
Butikacin (CAS 59733-86-7), with molecular formula C22H45N5O12 and molecular weight 571.31 g/mol. IUPAC: 2-[6-amino-3-[4-amino-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-[(4-amino-2-hydroxybutyl)amino]-2-hydroxycyclohexyl]oxy-6-(aminomethyl)oxane-3,4,5-triol.
Chemical Property Profile of Butikacin
Property Insights of Butikacin
The XLogP value of -7.6 indicates that Butikacin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 315.0 Ų indicates high polarity, suggesting Butikacin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Butikacin has 13 hydrogen bond donor(s) and 17 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Butikacin?
The CAS number of Butikacin is 59733-86-7.
What is the molecular formula of Butikacin?
The molecular formula of Butikacin is C22H45N5O12.
What is the molecular weight of Butikacin?
The molecular weight of Butikacin is 571.31 g/mol.
Where can I buy Butikacin?
You can request a quote for Butikacin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butikacin?
Yes, KEHONG BIO provides custom synthesis services for Butikacin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.