3',4'-Dideoxybutirosin A
TL;DR: 3',4'-Dideoxybutirosin A (CAS 54483-02-2) is a chemical compound with molecular formula C21H45Cl4N5O10 and molecular weight 667.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-N-[5-amino-4-[3-amino-6-(aminomethyl)oxan-2-yl]oxy-3-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-2-hydroxycyclohexyl]-2-hydroxybutanamide;tetrahydrochloride
Also Known As: 3',4'-Dideoxybutirosin A, D-Streptamine, O-2,6-diamino-2,3,4,6-tetradeoxy-alpha-D-erythro-hexopyranosyl-(1-4)-O-(beta-D-xylofuranosyl-(1-5))-N(sup 1)-(4-amino-2-hydroxy-1-oxobutyl)-2-deoxy-, tetrahydrochloride, (S)-, D-Streptamine, O-2,6-diamino-2,3,4,6-tetradeoxy-alpha-D-erythro-hexopyranosyl-(1-4)-O-(beta-D-xylofuranosyl-(1-5))-N1-(4-amino-2-hydroxy-1-oxobutyl)-2-deoxy-, tetrahydrochloride, (S)-, 4-amino-N-[5-amino-4-[3-amino-6-(aminomethyl)oxan-2-yl]oxy-3-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-2-hydroxycyclohexyl]-2-hydroxybutanamide tetrahydrochloride, 4-Amino-N-{5-amino-4-[(2,6-diamino-2,3,4,6-tetradeoxyhexopyranosyl)oxy]-2-hydroxy-3-(pentofuranosyloxy)cyclohexyl}-2-hydroxybutanimidic acid--hydrogen chloride (1/4)
| Molecular Formula | C21H45Cl4N5O10 |
|---|---|
| Molecular Weight | 667.19 g/mol |
| LogP | -4.0395 |
| Topological Polar Surface Area | 271.25 Ų |
| Hydrogen Bond Donors | 10 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 10 |
| Exact Mass | 667.1921 |
| Heavy Atoms | 40 |
| Complexity | 728.759 |
Chemical Identifiers
| CAS Number | 54483-02-2 |
|---|---|
| SMILES | C1CC(C(OC1CN)OC2C(CC(C(C2OC3C(C(C(O3)CO)O)O)O)NC(=O)C(CCN)O)N)N.Cl.Cl.Cl.Cl |
Product Overview
3',4'-Dideoxybutirosin A (CAS 54483-02-2), with molecular formula C21H45Cl4N5O10 and molecular weight 667.19 g/mol. IUPAC: 4-amino-N-[5-amino-4-[3-amino-6-(aminomethyl)oxan-2-yl]oxy-3-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-2-hydroxycyclohexyl]-2-hydroxybutanamide;tetrahydrochloride.
Chemical Property Profile of 3',4'-Dideoxybutirosin A
Property Insights of 3',4'-Dideoxybutirosin A
The XLogP value of -4.0395 indicates that 3',4'-Dideoxybutirosin A is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 271.25 Ų indicates high polarity, suggesting 3',4'-Dideoxybutirosin A may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3',4'-Dideoxybutirosin A has 10 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3',4'-Dideoxybutirosin A?
The CAS number of 3',4'-Dideoxybutirosin A is 54483-02-2.
What is the molecular formula of 3',4'-Dideoxybutirosin A?
The molecular formula of 3',4'-Dideoxybutirosin A is C21H45Cl4N5O10.
What is the molecular weight of 3',4'-Dideoxybutirosin A?
The molecular weight of 3',4'-Dideoxybutirosin A is 667.19 g/mol.
Where can I buy 3',4'-Dideoxybutirosin A?
You can request a quote for 3',4'-Dideoxybutirosin A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3',4'-Dideoxybutirosin A?
Yes, KEHONG BIO provides custom synthesis services for 3',4'-Dideoxybutirosin A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.