N-Deacetylcolchicine; (S)-form, 3-O-De-Me, N-Me
AlkaPlorer ID: AK294463
Synonym: 3-Demethyldemecolcine
IUPAC Name: 3-hydroxy-1,2,10-trimethoxy-7-(methylamino)-6,7-dihydro-5H-benzo[a]heptalen-9-one
Structure
SMILES: CNC1CCC2=CC(O)=C(OC)C(OC)=C2C2=CC=C(OC)C(=O)C=C21
InChI: InChI=1S/C20H23NO5/c1-21-14-7-5-11-9-16(23)19(25-3)20(26-4)18(11)12-6-8-17(24-2)15(22)10-13(12)14/h6,8-10,14,21,23H,5,7H2,1-4H3
InChIKey: XUCTUYPXJOLWKI-UHFFFAOYSA-N
Reference
Alkaloids from Leaves and Flowers of Colchicum autumnale L.<sup>1</sup>
PubChem CID: 14413736
CAS: 2034-50-6
LOTUS: LTS0184696
COCONUT: CNP0257893.1
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Colchicum | Colchicaceae | Liliales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Androcymbium melanthioides | Androcymbium | Colchicaceae | Liliales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| None | Colchicum | Colchicaceae | Liliales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 357.4060000000001
TPSA？: 77.02000000000001
MolLogP？: 2.6519000000000013
Number of H-Donors: 2
Number of H-Acceptors: 6
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|