| Phytochemical Name : Demecolcine |
| PCNDIDD0061 |
| Pubchem CID : 220401 |
| Molecular formula: C21H25NO5 |
| Canonical SMILES : CNC1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)OC)OC)OC)OC |
Synonymes : Demecolcine|colcemid|477-30-5|Colchamine|(-)-Demecolcine|Demecolcin|Reichstein's F|Colcemide|Desmecolcine|Substance F|N-Deacetyl-N-methylcolchicine|Santavy's substance F|(-)-Colchamine|Kolchamin|Kolkamin|Omain|Omaine|Methylcolchicine|N-Methyl-N-deacetylcolchicine|Deacetyl-N-methylcolchicine|Deacetylmethylcolchicine|N-Desacetyl-N-methylcolchicine|N-Methyl-N-desacetylcolchicine|Desacetylmethylcolchicine|Demecolcina|Demecolcinum|Kolchicin|Kolchicin [Czech]|N-Desacetylmethylcolchicine|Colchicine, N-deacetyl-N-methyl-|Colchamin|Alkaloid H 3, from colchicum antumnale|C-12669|(S)-1,2,3,10-Tetramethoxy-7-(methylamino)-6,7-dihydrobenzo[a]heptalen-9(5H)-one|Demecolcinum [INN-Latin]|Ciba 12669A|Demecolcina [INN-Spanish]|NSC-3096|Colchicine, 7-deacetamido-7-(methylamino)-|X 153|Demecolcine [INN:BAN:DCF]|CCRIS 2764|C21H25NO5|(7S)-1,2,3,10-tetramethoxy-7-(methylamino)-6,7-dihydrobenzo[a]heptalen-9(5H)-one|NSC 3096|EINECS 207-514-6|UNII-Z01IVE25KI|BRN 2822892|Z01IVE25KI|Ciba 12669 A|(7S)-1,2,3,10-tetramethoxy-7-(methylamino)-6,7-dihydro-5H-benzo[a]heptalen-9-one|CHEBI:4393|CHEMBL312862|Colchicine, deacetyl-N-methyl-|DTXSID7020342|Benzo(a)heptalen-9(5H)-one, 6,7-dihydro-1,2,3,10-tetramethoxy-7-(methylamino)-, (S)-|6,7-Dihydro-1,2,3,10-tetramethoxy-7-(methylamino)-benzo(alpha)heptalen-9(5H)-one|Demicolcine|(7S)-7-(methylamino)-1,2,3,10-tetrakis(methyloxy)-6,7-dihydrobenzo[a]heptalen-9(5H)-one|SMR000058249|4-14-00-00940 (Beilstein Handbook Reference)|Demecolcine [BAN:DCF:INN]|WLN: L B677 MV&T&J CO1 DO1 EO1 JM1 NO1|NSC3096|Desmecolchine|N-de-nu-acetyl-N-methylcolchicine|Benzo[a]heptalen-9(5H)-one, 6,7-dihydro-1,2,3,10-tetramethoxy-7-(methylamino)-, (S)-|Benzo[a]heptalen-9(5H)-one,7-dihydro-1,2,3,10-tetramethoxy-7-(methylamino)-, (S)-|Colcemid;Colchamin;Desmecolcine;Kolchamin|NCGC00166035-01|Alkaloid H 3|MFCD00075459|DEMECOLCINE [MI]|DEMECOLCINE [INN]|SCHEMBL8161|DEMECOLCINE [WHO-DD]|MLS001332501|MLS001332502|MLS002695919|DTXCID70342|Colchine, N-deacetyl-N-methyl|cid_220401|BCBcMAP01_000022|Demecolcine, >=98% (HPLC)|(7S)-6,7-Dihydro-1,2,3,10-tetramethoxy-7-(methylamino)benzo[a]heptalen-9(5H)-one|Benzo[a]heptalen-9(5H)-one, 6,7-dihydro-1,2,3,10-tetramethoxy-7-(methylamino)-, (7S)-|HMS2230L17|HY-N0282|Tox21_112296|BDBM50014872|NSC403147|AKOS002141248|DB13318|KS-5002|LS-7285|NSC-403147|SMP1_000076|Colcemid, N-methyl-N-deacetyl-colchicine|NCGC00166035-02|CAS-477-30-5|4-Amino-furazan-3-carboxylicacidmethylamide|CS-0008779|A827317|Q903666|SR-01000841244|Demecolcine, >=98.0% (sum of enantiomers, HPLC)|SR-01000841244-3|BRD-K38624570-001-10-7|6,2,3,10-tetramethoxy-7-(methylamino)-benzo[.alpha.]heptalen-9(5H)-one|Demecolcine, Hybri-Max(TM), powder, gamma-irradiated, hybridoma tested|(S)-1,2,3,10-tetramethoxy-7-methylamino-6,7-dihydro-5H-benzo[a]heptalen-9-one|(S)-6,7-dihydro-1,2,3,10-tetramethoxy-7-(methylamino)benzo[a]heptalen-9(5H)-one|1,2,3,10-Tetramethoxy-7-(methylamino)-6,7-dihydrobenzo[a]heptalen-9(5H)-one #|1,2,3,10-Tetramethoxy-7-methylamino-6,7-dihydro-5H-benzo[a]heptalen-9-one (Demecolcine)|6,7-Dihydro-1,2,3,10-tetramethoxy-7-(methylamino)-benzo(a)heptalen-9(5H)-one|LON |
| Structure | |
| 3D structure | 2D structure |
![]() |
| Log Po/w (iLOGP) : 4.120 |
| Log Po/w (XLOGP3) : 7.640 |
| Log Po/w (WLOGP) : 6.110 |
| Log Po/w (MLOGP) : 4.570 |
| Log Po/w (SILICOS-IT) : 5.950 |
| Consensus Log Po/w : 5.680 |

