Colchiceine, N-deacetyl-N-benzoyl-
N-[(7S)-10-hydroxy-1,2,3-trimethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]benzamide
Also Known As: N-Benzoyl trimethylcolchicinic acid|Colchiceine, N-benzoyl-N-deacetyl-|Colchiceine, N-deacetyl-N-benzoyl-|Benzo(a)heptalen-9(5H)-one, 7-benzamido-6,7-dihydro-10-hydroxy-1,2,3-trimethoxy-|Benzamide, N-(5,6,7,9-terahydro-10-hydroxy-1,2,3-trimethoxy-9-oxobenzo(a)heptalen-7-yl)-, (S)-|n-[(7s)-10-hydroxy-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl]benzamide|N-[(7S)-10-hydroxy-1,2,3-trimethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]benzamide|N-(10-Hydroxy-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl)benzenecarboximidic acid|N-[(7S)-10-Hydroxy-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl]benzenecarboximidic acid
| Molecular Formula | C26H25NO6 |
|---|---|
| Molecular Weight | 447.16818 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 94.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 447.16818 |
| Monoisotopic Mass | 447.16818 |
| Heavy Atoms | 33 |
| Complexity | 840.0 |
Chemical Identifiers
| CAS Number | 17006-89-2 |
|---|---|
| SMILES | COC1=C(C(=C2C(=C1)CC[C@@H](C3=CC(=O)C(=CC=C32)O)NC(=O)C4=CC=CC=C4)OC)OC |
| InChIKey | IHMBFORMNABTCS-IBGZPJMESA-N |
Product Overview
Colchiceine, N-deacetyl-N-benzoyl- (CAS 17006-89-2), with molecular formula C26H25NO6 and molecular weight 447.16818 g/mol. IUPAC: N-[(7S)-10-hydroxy-1,2,3-trimethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]benzamide.