Acetoneberberine

Base Information

• Chemical Name: Acetoneberberine
• CAS No.: 39024-13-0
• Molecular Formula: C₂₃H₂₃NO₅
• Molecular Weight: 393.439
• DSSTox Substance ID: DTXSID80959865
• Nikkaji Number: J23.909G
• Mol file: 39024-13-0.mol

Synonyms:acetoneberberine

Chemical Property of Acetoneberberine

Chemical Property:

• XLogP3: 3.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 4
• Exact Mass: 393.15762283
• Heavy Atom Count: 29
• Complexity: 666

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MSDS Files:

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• Canonical SMILES: CC(=O)CC1C2=C(C=CC(=C2OC)OC)C=C3N1CCC4=CC5=C(C=C43)OCO5

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