Nanaomycin B

Base Information

• Chemical Name: Nanaomycin B
• CAS No.: 52934-85-7
• Molecular Formula: C16H16 O7
• Molecular Weight: 320.29
• DSSTox Substance ID: DTXSID80967405
• Wikidata: Q82949999
• Mol file: 52934-85-7.mol

Synonyms:nanaomycin B

Chemical Property of Nanaomycin B

Chemical Property:

• Vapor Pressure: 1.88E-17mmHg at 25°C
• Boiling Point: 643.7°Cat760mmHg
• PKA: 4.25±0.10(Predicted)
• Flash Point: 242.9°C
• PSA: 121.13000
• Density: 1.492g/cm³
• LogP: 0.77060
• XLogP3: 0.6
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 2
• Exact Mass: 320.08960285
• Heavy Atom Count: 23
• Complexity: 545

Purity/Quality:

NANAOMYCIN B 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1C2(C(CC(O1)CC(=O)O)C(=O)C3=C(C2=O)C(=CC=C3)O)O
• Isomeric SMILES: CC1[C@@]2(C(C[C@@H](O1)CC(=O)O)C(=O)C3=C(C2=O)C(=CC=C3)O)O