O-Methylmicranthine

Base Information

• Chemical Name: O-Methylmicranthine
• CAS No.: 40225-93-2
• Molecular Formula: C35H34N2O5
• Molecular Weight: 562.6549
• DSSTox Substance ID: DTXSID60420048
• Wikidata: Q82231305
• ChEMBL ID: CHEMBL2063765

Synonyms:O-Methylmicranthine;NSC626656;40225-93-2;NSC-626656;CHEMBL2063765;DTXSID60420048

Chemical Property of O-Methylmicranthine

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• Density: 1.242g/cm³
• XLogP3: 5.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 2
• Exact Mass: 562.24677219
• Heavy Atom Count: 42
• Complexity: 929

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1CCC2=CC(=C3C4=C2C1CC5=CC=C(C=C5)OC6=C(C=CC(=C6)CC7C8=CC(=C(O3)C=C8CCN7)O4)OC)OC
• Isomeric SMILES: CN1CCC2=CC(=C3C4=C2[C@H]1CC5=CC=C(C=C5)OC6=C(C=CC(=C6)C[C@@H]7C8=CC(=C(O3)C=C8CCN7)O4)OC)OC

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