4''-Demethylgentamicin-C1
TL;DR: 4''-Demethylgentamicin-C1 (CAS 66322-28-9) is a chemical compound with molecular formula C20H41N5O7 and molecular weight 463.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4,6-diamino-3-[3-amino-6-[1-(methylamino)ethyl]oxan-2-yl]oxy-2-hydroxycyclohexyl]oxy-4-(methylamino)oxane-3,5-diol
Also Known As: 4''-Demethylgentamicin-C1, 4''-Demethylgentamicin C1, Streptamine, O-2-amino-2,3,4,6,7-pentadeoxy-6-(methylamino)-alpha-D-ribo-heptopyranosyl-(1-4)-O-(3-deoxy-3-(methylamino)-beta-L-arabinopyranosyl-(1-6))-2-deoxy-, D-, 2-[4,6-diamino-3-[3-amino-6-[1-(methylamino)ethyl]oxan-2-yl]oxy-2-hydroxycyclohexyl]oxy-4-(methylamino)oxane-3,5-diol, 4,6-Diamino-3-{[3-deoxy-3-(methylamino)pentopyranosyl]oxy}-2-hydroxycyclohexyl 2-amino-2,3,4,6,7-pentadeoxy-6-(methylamino)heptopyranoside
| Molecular Formula | C20H41N5O7 |
|---|---|
| Molecular Weight | 463.30 g/mol |
| LogP | -3.7176 |
| Topological Polar Surface Area | 199.73 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 7 |
| Exact Mass | 463.3006 |
| Heavy Atoms | 32 |
| Complexity | 592.5419 |
Chemical Identifiers
| CAS Number | 66322-28-9 |
|---|---|
| SMILES | CC(C1CCC(C(O1)OC2C(CC(C(C2O)OC3C(C(C(CO3)O)NC)O)N)N)N)NC |
Product Overview
4''-Demethylgentamicin-C1 (CAS 66322-28-9), with molecular formula C20H41N5O7 and molecular weight 463.30 g/mol. IUPAC: 2-[4,6-diamino-3-[3-amino-6-[1-(methylamino)ethyl]oxan-2-yl]oxy-2-hydroxycyclohexyl]oxy-4-(methylamino)oxane-3,5-diol.
Chemical Property Profile of 4''-Demethylgentamicin-C1
Property Insights of 4''-Demethylgentamicin-C1
The XLogP value of -3.7176 indicates that 4''-Demethylgentamicin-C1 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 199.73 Ų indicates high polarity, suggesting 4''-Demethylgentamicin-C1 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4''-Demethylgentamicin-C1 has 8 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4''-Demethylgentamicin-C1?
The CAS number of 4''-Demethylgentamicin-C1 is 66322-28-9.
What is the molecular formula of 4''-Demethylgentamicin-C1?
The molecular formula of 4''-Demethylgentamicin-C1 is C20H41N5O7.
What is the molecular weight of 4''-Demethylgentamicin-C1?
The molecular weight of 4''-Demethylgentamicin-C1 is 463.30 g/mol.
Where can I buy 4''-Demethylgentamicin-C1?
You can request a quote for 4''-Demethylgentamicin-C1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4''-Demethylgentamicin-C1?
Yes, KEHONG BIO provides custom synthesis services for 4''-Demethylgentamicin-C1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.