Aglycone C

Base Information

• Chemical Name: Aglycone C
• CAS No.: 116455-20-0
• Molecular Formula: C21H20 O8
• Molecular Weight: 400.38
• DSSTox Substance ID: DTXSID50863400
• Mol file: 116455-20-0.mol

Synonyms:7-deoxy-13-dihydroadriamycinone;7-deoxydoxorubicinolone;aglycone C

Chemical Property of Aglycone C

Chemical Property:

• Vapor Pressure: 1.25E-24mmHg at 25°C
• Boiling Point: 765.3°Cat760mmHg
• Flash Point: 274.8°C
• PSA: 144.52000
• Density: 1.583g/cm³
• LogP: 0.45480
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 3
• Exact Mass: 400.11581759
• Heavy Atom Count: 29
• Complexity: 667

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC=CC2=C1C(=O)C3=C(C4=C(CC(CC4)(C(CO)O)O)C(=C3C2=O)O)O