7-Amino-2-[5-amino-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-(4,6-diamino-2,3-dihydroxycyclohexyl)oxy-3-(methylamino)-2,3,4,4a,6,7,8,8a-octahydropyrano[3,2-b]pyran-4,8-diol

Base Information

• Chemical Name: 7-Amino-2-[5-amino-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-(4,6-diamino-2,3-dihydroxycyclohexyl)oxy-3-(methylamino)-2,3,4,4a,6,7,8,8a-octahydropyrano[3,2-b]pyran-4,8-diol
• CAS No.: 56283-52-4
• Molecular Formula: C21H41 N5 O12
• Molecular Weight: 555.58
• DSSTox Substance ID: DTXSID101317928
• Mol file: 56283-52-4.mol

Synonyms:DTXSID101317928;LS-146913

Chemical Property of 7-Amino-2-[5-amino-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-(4,6-diamino-2,3-dihydroxycyclohexyl)oxy-3-(methylamino)-2,3,4,4a,6,7,8,8a-octahydropyrano[3,2-b]pyran-4,8-diol

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 880.5°Cat760mmHg
• PKA: 12.74±0.70(Predicted)
• Flash Point: 486.3°C
• PSA: 303.87000
• Density: 1.62g/cm³
• LogP: -4.78640
• XLogP3: -8
• Hydrogen Bond Donor Count: 12
• Hydrogen Bond Acceptor Count: 17
• Rotatable Bond Count: 6
• Exact Mass: 555.27517176
• Heavy Atom Count: 38
• Complexity: 791

Purity/Quality:

OXYAPRAMYCIN 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CNC1C(C2C(C(C(C(O2)OC3C(CC(C(C3O)O)N)N)N)O)OC1OC4C(C(C(C(O4)CO)N)O)O)O