Sulfurmycin B

Base Information

• Chemical Name: Sulfurmycin B
• CAS No.: 78193-30-3
• Molecular Formula: C₄₃H₅₁NO₁₆
• Molecular Weight: 837.875
• Wikidata: Q105104178
• Mol file: 78193-30-3.mol

Synonyms:sulfurmycin B

Chemical Property of Sulfurmycin B

Chemical Property:

• Melting Point: 149°C
• Refractive Index: 1.5280 (estimate)
• Boiling Point: 767.63°C (rough estimate)
• Flash Point: 501.3oC
• PSA: 223.12000
• Density: 1.2457 (rough estimate)
• LogP: 2.74320
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 17
• Rotatable Bond Count: 9
• Exact Mass: 837.32078454
• Heavy Atom Count: 60
• Complexity: 1680

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1C2C(CC(O1)OC3C(OC(CC3N(C)C)OC4CC(C(C5=CC6=C(C(=C45)O)C(=O)C7=C(C6=O)C=CC=C7O)C(=O)OC)(CC(=O)C)O)C)OC8CC(=O)C(OC8O2)C
• Isomeric SMILES: C[C@H]1[C@@H]2[C@H](C[C@@H](O1)O[C@@H]3[C@@H](O[C@H](C[C@@H]3N(C)C)O[C@H]4C[C@@]([C@@H](C5=CC6=C(C(=C45)O)C(=O)C7=C(C6=O)C=CC=C7O)C(=O)OC)(CC(=O)C)O)C)O[C@H]8CC(=O)[C@@H](O[C@H]8O2)C