Demecolcine
(7S)-1,2,3,10-tetramethoxy-7-(methylamino)-6,7-dihydro-5H-benzo[a]heptalen-9-one
Also Known As: Demecolcine|colcemid|Colchamine|Demecolcin|Desmecolcine|Colcemide|Kolchamin|Kolkamin|Omaine|Omain|(-)-Demecolcine|Methylcolchicine|Reichstein's F|Demecolcina|Substance F|Demecolcinum|Kolchicin|Santavy's substance F|(-)-Colchamine|Colchamin|Deacetylmethylcolchicine|Desmecolchine|Desacetylmethylcolchicine|N-Deacetyl-N-methylcolchicine|Deacetyl-N-methylcolchicine|Demicolcine|Kolchicin [Czech]|Osamin|N-Methyl-N-deacetylcolchicine|Compound F|N-Desacetyl-N-methylcolchicine|N-Methyl-N-desacetylcolchicine|N-Methyldemecolcine|Alkaloid H 3|N-Desacetylmethylcolchicine|Ciba 12669A|Colcemid (Standard)|Demecolcinum [INN-Latin]|Demecolcina [INN-Spanish]|Colchicine, N-deacetyl-N-methyl-|Demecolcine [INN:BAN:DCF]|DEMECOLCINE [MI]
| Molecular Formula | C21H25NO5 |
|---|---|
| Molecular Weight | 371.17328 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 66.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 371.17328 |
| Monoisotopic Mass | 371.17328 |
| Heavy Atoms | 27 |
| Complexity | 653.0 |
Chemical Identifiers
| CAS Number | 66569-05-9 |
|---|---|
| SMILES | CN[C@H]1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)OC)OC)OC)OC |
| InChIKey | NNJPGOLRFBJNIW-HNNXBMFYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Demecolcine (CAS 66569-05-9), with molecular formula C21H25NO5 and molecular weight 371.17328 g/mol. IUPAC: (7S)-1,2,3,10-tetramethoxy-7-(methylamino)-6,7-dihydro-5H-benzo[a]heptalen-9-one.
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