1,2,3-Demethylcolchiceine

Base Information

• Chemical Name: 1,2,3-Demethylcolchiceine
• CAS No.: 134568-30-2
• Molecular Formula: C18H17NO6
• Molecular Weight: 343.3307
• DSSTox Substance ID: DTXSID90158802
• ChEMBL ID: CHEMBL465327
• Mol file: 134568-30-2.mol

Synonyms:1,2,3-Demethylcolchiceine;134568-30-2;N-[(7S)-1,2,3,10-tetrahydroxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide;Acetamide, N-(5,6,7,9-tetrahydro-1,2,3,10-tetrahydroxy-9-oxobenzo[a]heptalen-7-yl)-, (S)-;Acetamide, N-(5,6,7,9-tetrahydro-1,2,3,10-tetrahydroxy-9-oxobenzo(a)heptalen-7-yl)-, (S)-;CHEMBL465327;SCHEMBL12656844;DTXSID90158802

Chemical Property of 1,2,3-Demethylcolchiceine

Chemical Property:

• Vapor Pressure: 2.97E-30mmHg at 25°C
• Boiling Point: 843.9°C at 760 mmHg
• Flash Point: 464.2°C
• PSA: 130.58000
• Density: 1.57g/cm³
• LogP: 2.49990
• XLogP3: 0.2
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 1
• Exact Mass: 343.10558726
• Heavy Atom Count: 25
• Complexity: 679

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)NC1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)O)O)O)O
• Isomeric SMILES: CC(=O)N[C@H]1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)O)O)O)O

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