Unii-6PM4une85T

Base Information

• Chemical Name: Unii-6PM4une85T
• CAS No.: 53216-90-3
• Deprecated CAS: 59157-27-6,1393-90-4
• Molecular Formula: C22H27N3O7S
• Molecular Weight: 477.58
• Hs Code.: 2941900000
• UNII: 6PM4UNE85T
• Nikkaji Number: J1.325.990I
• Mol file: 53216-90-3.mol

Synonyms:griseoviridin

Chemical Property of Unii-6PM4une85T

Chemical Property:

• Melting Point: 162°C (rough estimate)
• Refractive Index: 1.6390 (estimate)
• Boiling Point: 920.5°Cat760mmHg
• Flash Point: 510.5°C
• Density: 1.4g/cm³
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 0
• Exact Mass: 477.15697138
• Heavy Atom Count: 33
• Complexity: 816

Purity/Quality:

99% ^*data from raw suppliers

Griseoviridin ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1CC=C2C(=O)NCC=CC=CC(CC(CC3=NC(=CO3)C(=O)NC(CS2)C(=O)O1)O)O
• Isomeric SMILES: C[C@@H]1C/C=C\2/C(=O)NC/C=C/C=C/[C@H](C[C@H](CC3=NC(=CO3)C(=O)N[C@H](CS2)C(=O)O1)O)O