1-N-(3-amino-2-hydroxybutanoyl)-2',3'-dideoxykanamycin A
TL;DR: 1-N-(3-amino-2-hydroxybutanoyl)-2',3'-dideoxykanamycin A (CAS 117325-82-3) is a chemical compound with molecular formula C22H43N5O11 and molecular weight 553.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-N-[5-amino-2-[4-amino-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-[6-(aminomethyl)-5-hydroxyoxan-2-yl]oxy-3-hydroxycyclohexyl]-2-hydroxybutanamide
Also Known As: Ahb-kanamycin A, 1-N-(3-Amino-2-hydroxybutanoyl)-2',3'-dideoxykanamycin A, 3-amino-N-[5-amino-2-[4-amino-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-[6-(aminomethyl)-5-hydroxyoxan-2-yl]oxy-3-hydroxycyclohexyl]-2-hydroxybutanamide, 3-Amino-N-{5-amino-2-[(3-amino-3-deoxyhexopyranosyl)oxy]-4-[(6-amino-2,3,6-trideoxyhexopyranosyl)oxy]-3-hydroxycyclohexyl}-2-hydroxybutanimidic acid, RefChem:76438
| Molecular Formula | C22H43N5O11 |
|---|---|
| Molecular Weight | 553.30 g/mol |
| LogP | -5.3 |
| Topological Polar Surface Area | 291.0 Ų |
| Hydrogen Bond Donors | 11 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 9 |
| Exact Mass | 553.2959 |
| Heavy Atoms | 38 |
| Complexity | 771.0 |
Chemical Identifiers
| CAS Number | 117325-82-3 |
|---|---|
| SMILES | CC(C(C(=O)NC1CC(C(C(C1OC2C(C(C(C(O2)CO)O)N)O)O)OC3CCC(C(O3)CN)O)N)O)N |
| InChIKey | BNLLRXUMXDAIBY-UHFFFAOYSA-N |
Product Overview
1-N-(3-amino-2-hydroxybutanoyl)-2',3'-dideoxykanamycin A (CAS 117325-82-3), with molecular formula C22H43N5O11 and molecular weight 553.30 g/mol. IUPAC: 3-amino-N-[5-amino-2-[4-amino-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-[6-(aminomethyl)-5-hydroxyoxan-2-yl]oxy-3-hydroxycyclohexyl]-2-hydroxybutanamide.
Chemical Property Profile of 1-N-(3-amino-2-hydroxybutanoyl)-2',3'-dideoxykanamycin A
Property Insights of 1-N-(3-amino-2-hydroxybutanoyl)-2',3'-dideoxykanamycin A
The XLogP value of -5.3 indicates that 1-N-(3-amino-2-hydroxybutanoyl)-2',3'-dideoxykanamycin A is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 291.0 Ų indicates high polarity, suggesting 1-N-(3-amino-2-hydroxybutanoyl)-2',3'-dideoxykanamycin A may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1-N-(3-amino-2-hydroxybutanoyl)-2',3'-dideoxykanamycin A has 11 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-N-(3-amino-2-hydroxybutanoyl)-2',3'-dideoxykanamycin A?
The CAS number of 1-N-(3-amino-2-hydroxybutanoyl)-2',3'-dideoxykanamycin A is 117325-82-3.
What is the molecular formula of 1-N-(3-amino-2-hydroxybutanoyl)-2',3'-dideoxykanamycin A?
The molecular formula of 1-N-(3-amino-2-hydroxybutanoyl)-2',3'-dideoxykanamycin A is C22H43N5O11.
What is the molecular weight of 1-N-(3-amino-2-hydroxybutanoyl)-2',3'-dideoxykanamycin A?
The molecular weight of 1-N-(3-amino-2-hydroxybutanoyl)-2',3'-dideoxykanamycin A is 553.30 g/mol.
Where can I buy 1-N-(3-amino-2-hydroxybutanoyl)-2',3'-dideoxykanamycin A?
You can request a quote for 1-N-(3-amino-2-hydroxybutanoyl)-2',3'-dideoxykanamycin A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-N-(3-amino-2-hydroxybutanoyl)-2',3'-dideoxykanamycin A?
Yes, KEHONG BIO provides custom synthesis services for 1-N-(3-amino-2-hydroxybutanoyl)-2',3'-dideoxykanamycin A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.