1-N-(4-Guanidino-2-hydroxybutyryl)kanamycin
TL;DR: 1-N-(4-Guanidino-2-hydroxybutyryl)kanamycin (CAS 136345-19-2) is a chemical compound with molecular formula C23H49N7O21S2 and molecular weight 823.2423 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[5-amino-2-[4-amino-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-[6-(aminomethyl)-3,4,5-trihydroxyoxan-2-yl]oxy-3-hydroxycyclohexyl]-4-(diaminomethylideneamino)-2-hydroxybutanamide;sulfuric acid
Also Known As: 1-N-(4-Guanidino-2-hydroxybutyryl)kanamycin, D-Streptamine, O-3-amino-3-deoxy-alpha-D-glucopyranosyl-(1-6)-O-(6-amino-6-deoxy-alpha-D-glucopyranosyl-(1-4))-N1-(4-((aminoiminomethyl)amino)-2-hydroxy-1-oxobutyl)-2-deoxy-, (S)-, sulfate (1:2) (salt), N-[5-amino-2-[4-amino-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-[6-(aminomethyl)-3,4,5-trihydroxyoxan-2-yl]oxy-3-hydroxycyclohexyl]-4-(diaminomethylideneamino)-2-hydroxybutanamide; sulfuric acid, N-{5-Amino-2-[(3-amino-3-deoxyhexopyranosyl)oxy]-4-[(6-amino-6-deoxyhexopyranosyl)oxy]-3-hydroxycyclohexyl}-4-(carbamimidoylamino)-2-hydroxybutanimidic acid--sulfuric acid (1/2), N-{5-Amino-2-[(3-amino-3-deoxyhexopyranosyl)oxy]-4-[(6-amino-6-deoxyhexopyranosyl)oxy]-3-hydroxycyclohexyl}-4-carbamimidamido-2-hydroxybutanimidic acid--sulfuric acid (1/2)
Technical Specifications
| Molecular Formula | C23H49N7O21S2 |
| Molecular Weight | 823.2423 g/mol |
| XLogP | -10.4151 |
| Topological Polar Surface Area (TPSA) | 536.0 Ų |
| Hydrogen Bond Donors | 18 |
| Hydrogen Bond Acceptors | 25 |
| Rotatable Bonds | 11 |
| Exact Mass | 823.2423 Da |
| Heavy Atoms | 53 |
| Complexity | 1020.0 |
| SMILES | C1C(C(C(C(C1NC(=O)C(CCN=C(N)N)O)OC2C(C(C(C(O2)CO)O)N)O)O)OC3C(C(C(C(O3)CN)O)O)O)N.OS(=O)(=O)O.OS(=O)(=O)O |
| InChIKey | JTZPFBIQOWYRKO-UHFFFAOYSA-N |
Chemical Property Profile of 1-N-(4-Guanidino-2-hydroxybutyryl)kanamycin
Property Insights of 1-N-(4-Guanidino-2-hydroxybutyryl)kanamycin
The XLogP value of -10.4151 indicates that 1-N-(4-Guanidino-2-hydroxybutyryl)kanamycin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 536.0 Ų indicates high polarity, suggesting 1-N-(4-Guanidino-2-hydroxybutyryl)kanamycin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1-N-(4-Guanidino-2-hydroxybutyryl)kanamycin has 18 hydrogen bond donor(s) and 25 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 1-N-(4-Guanidino-2-hydroxybutyryl)kanamycin?
The CAS number of 1-N-(4-Guanidino-2-hydroxybutyryl)kanamycin is 136345-19-2.
What is the molecular formula of 1-N-(4-Guanidino-2-hydroxybutyryl)kanamycin?
The molecular formula of 1-N-(4-Guanidino-2-hydroxybutyryl)kanamycin is C23H49N7O21S2.
What is the molecular weight of 1-N-(4-Guanidino-2-hydroxybutyryl)kanamycin?
The molecular weight of 1-N-(4-Guanidino-2-hydroxybutyryl)kanamycin is 823.2423 g/mol.
Where can I buy 1-N-(4-Guanidino-2-hydroxybutyryl)kanamycin?
You can request a quote for 1-N-(4-Guanidino-2-hydroxybutyryl)kanamycin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-N-(4-Guanidino-2-hydroxybutyryl)kanamycin?
Yes, CoreyChem provides custom synthesis services for 1-N-(4-Guanidino-2-hydroxybutyryl)kanamycin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.