Olivomycin A

Base Information

• Chemical Name: Olivomycin A
• CAS No.: 6988-58-5
• Molecular Formula: C58H84 O26
• Molecular Weight: 1197.42
• UNII: 06720J8X69
• DSSTox Substance ID: DTXSID101024454
• Nikkaji Number: J152.114D
• Wikidata: Q27123480
• Metabolomics Workbench ID: 58283
• ChEMBL ID: CHEMBL576383
• Mol file: 6988-58-5.mol

Synonyms:olivomycin A

Chemical Property of Olivomycin A

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Melting Point: 160-165°
• Refractive Index: 1.6500 (estimate)
• Boiling Point: 1151.2°C at 760 mmHg
• Flash Point: 310.4°C
• PSA: 359.34000
• Density: 1.41g/cm³
• LogP: 1.87410
• XLogP3: 3
• Hydrogen Bond Donor Count: 8
• Hydrogen Bond Acceptor Count: 26
• Rotatable Bond Count: 21
• Exact Mass: 1196.52508278
• Heavy Atom Count: 84
• Complexity: 2210

Purity/Quality:

99% ^*data from raw suppliers

OLIVOMYCIN A 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1C(C(CC(O1)OC2C(CC3=CC4=CC(=CC(=C4C(=C3C2=O)O)O)OC5CC(C(C(O5)C)OC(=O)C)OC6CC(C(C(O6)C)OC)O)C(C(=O)C(C(C)O)O)OC)OC7CC(C(C(O7)C)O)OC8CC(C(C(O8)C)OC(=O)C(C)C)(C)O)O
• Isomeric SMILES: C[C@@H]1[C@H]([C@@H](C[C@@H](O1)O[C@H]2[C@@H](CC3=CC4=CC(=CC(=C4C(=C3C2=O)O)O)O[C@H]5C[C@H]([C@H]([C@H](O5)C)OC(=O)C)O[C@@H]6C[C@H]([C@H]([C@H](O6)C)OC)O)[C@@H](C(=O)[C@H]([C@@H](C)O)O)OC)O[C@H]7C[C@H]([C@@H]([C@H](O7)C)O)O[C@H]8C[C@]([C@H]([C@@H](O8)C)OC(=O)C(C)C)(C)O)O