Molecule

N-Deacetylcolchicine; (S)-form, 2-O-De-Me, N-Me

AlkaPlorer ID: AK294462

Synonym: 2-Demethyldemecolcine, Substance S, Alkaloid CC 7

IUPAC Name: 2-hydroxy-1,3,10-trimethoxy-7-(methylamino)-6,7-dihydro-5H-benzo[a]heptalen-9-one

SMILES: CNC1CCC2=CC(OC)=C(O)C(OC)=C2C2=CC=C(OC)C(=O)C=C21

InChI: InChI=1S/C20H23NO5/c1-21-14-7-5-11-9-17(25-3)19(23)20(26-4)18(11)12-6-8-16(24-2)15(22)10-13(12)14/h6,8-10,14,21,23H,5,7H2,1-4H3

InChIKey: KEOVUWFJHROWNK-UHFFFAOYSA-N

PubChem CID: 14413735

CAS: 7359-91-3

LOTUS: LTS0171476

COCONUT: CNP0253690.1

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
None	Merendera	Colchicaceae	Liliales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
None	Colchicum	Colchicaceae	Liliales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Colchicum autumnale	Colchicum	Colchicaceae	Liliales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Colchicum speciosum	Colchicum	Colchicaceae	Liliales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Androcymbium melanthioides	Androcymbium	Colchicaceae	Liliales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
None	Colchicum	Colchicaceae	Liliales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Molecule Weight: 357.4060000000001

TPSA？: 77.02000000000001

MolLogP？: 2.6519000000000013

Number of H-Donors: 2

Number of H-Acceptors: 6

RingCount: 3

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi