1-N-((S)-4-Amino-2-hydroxybutyryl)-3'-deoxykanamycin C hydrate

Base Information

• Chemical Name: 1-N-((S)-4-Amino-2-hydroxybutyryl)-3'-deoxykanamycin C hydrate
• CAS No.: 65566-78-1
• Molecular Formula: C22H43N5O12
• Molecular Weight: 569.6031
• DSSTox Substance ID: DTXSID00984154
• Mol file: 65566-78-1.mol

Synonyms:1-N-((S)-4-Amino-2-hydroxybutyryl)-3'-deoxykanamycin C hydrate;65566-78-1;D-Streptamine, O-3-amino-3-deoxy-alpha-D-glucopyranosyl)-(1-6)-O-(2-amino-2,3-dideoxy-alpha-D-ribo-hexopyranosyl-(1-4)-N(sup 1)-(4-amino-2-hydroxy-1-oxobutyl)-2-deoxy-, (S)-, hydrate;DTXSID00984154;C22H43N5O12.H2O;C22-H43-N5-O12.H2-O;LS-146911;4-Amino-N-{5-amino-2-[(3-amino-3-deoxyhexopyranosyl)oxy]-4-[(2-amino-2,3-dideoxyhexopyranosyl)oxy]-3-hydroxycyclohexyl}-2-hydroxybutanimidic acid

Chemical Property of 1-N-((S)-4-Amino-2-hydroxybutyryl)-3'-deoxykanamycin C hydrate

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 958.9°Cat760mmHg
• Flash Point: 533.7°C
• Density: 1.55g/cm³
• XLogP3: -6.9
• Hydrogen Bond Donor Count: 12
• Hydrogen Bond Acceptor Count: 16
• Rotatable Bond Count: 10
• Exact Mass: 569.29082182
• Heavy Atom Count: 39
• Complexity: 788

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C(C(C(C(C1NC(=O)C(CCN)O)OC2C(C(C(C(O2)CO)O)N)O)O)OC3C(CC(C(O3)CO)O)N)N