9,4''-Diacetyl-4''-depropionylmidecamycin

Base Information

• Chemical Name: 9,4''-Diacetyl-4''-depropionylmidecamycin
• CAS No.: 65178-01-0
• Molecular Formula: C42H67 N O16
• Molecular Weight: 841.97848
• Mol file: 65178-01-0.mol

Synonyms:9,4''-Diacetyl-4''-depropionylmidecamycin;Leucomycin V, 4(sup B),9-diacetate 3-propanoate;65178-01-0;LS-87900

Chemical Property of 9,4''-Diacetyl-4''-depropionylmidecamycin

Chemical Property:

• Vapor Pressure: 3.39E-35mmHg at 25°C
• Boiling Point: 868.4°C at 760 mmHg
• Flash Point: 479°C
• Density: 1.22g/cm³
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 17
• Rotatable Bond Count: 15
• Exact Mass: 841.44598505
• Heavy Atom Count: 59
• Complexity: 1450

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: CCC(=O)OC1CC(=O)OC(CC=CC=CC(C(CC(C(C1OC)OC2C(C(C(C(O2)C)OC3CC(C(C(O3)C)OC(=O)C)(C)O)N(C)C)O)CC=O)C)OC(=O)C)C
• Isomeric SMILES: CCC(=O)O[C@@H]1CC(=O)O[C@@H](C/C=C/C=C/[C@@H]([C@@H](C[C@@H]([C@@H]([C@H]1OC)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C)O[C@H]3C[C@@]([C@H]([C@@H](O3)C)OC(=O)C)(C)O)N(C)C)O)CC=O)C)OC(=O)C)C

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