Leucinostatin B

Base Information

• Chemical Name: Leucinostatin B
• CAS No.: 76663-52-0
• Molecular Formula: C61H109N11O13
• Molecular Weight: 1204.58
• DSSTox Substance ID: DTXSID801346217
• Mol file: 76663-52-0.mol

Synonyms:leucinostatin B;paecilotoxin B

Chemical Property of Leucinostatin B

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Refractive Index: 1.515
• Boiling Point: 1414.2 °C at 760 mmHg
• Flash Point: 809.1 °C
• PSA: 383.18000
• Density: 1.119 g/cm³
• LogP: 9.82670
• XLogP3: 3.8
• Hydrogen Bond Donor Count: 12
• Hydrogen Bond Acceptor Count: 14
• Rotatable Bond Count: 37
• Exact Mass: 1203.82063257
• Heavy Atom Count: 85
• Complexity: 2300

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(C)C=CC(=O)N1CC(CC1C(=O)NC(CC(C)CC(CC(=O)CC)O)C(=O)NC(C(C(C)C)O)C(=O)NC(C)(C)C(=O)NC(CC(C)C)C(=O)NC(CC(C)C)C(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)NCCC(=O)NC(C)CNC)C
• Isomeric SMILES: CCC(C)/C=C/C(=O)N1CC(CC1C(=O)NC(CC(C)CC(CC(=O)CC)O)C(=O)NC(C(C(C)C)O)C(=O)NC(C)(C)C(=O)NC(CC(C)C)C(=O)NC(CC(C)C)C(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)NCCC(=O)NC(C)CNC)C