Compound Identification
SMILES
COC1=C(O)C=C2CC[C@H]3N(CCC4=CC(O)=C(OC)C(C2=C1)=C34)C(=O)C(F)(F)F
InChIKey
InChIKey=WIIZKNYQCVABAG-CYBMUJFWSA-N
Formula
C21H20F3NO5
Mass
423.388
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
- Class Allocolchicine alkaloids
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Allocolchicine alkaloids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Allocolchicine alkaloids
Alternative Parents
Homoaporphines Tetrahydroisoquinolines Anisoles Alkyl aryl ethers 1-hydroxy-2-unsubstituted benzenoids Tertiary carboxylic acid amides Azacyclic compounds Organonitrogen compounds Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Homoaporphine - Allocolchicine alkaloid skeleton - Tetrahydroisoquinoline - Anisole - Phenol ether - Alkyl aryl ether - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Benzenoid - Tertiary carboxylic acid amide - Carboxamide group - Azacycle - Ether - Carboxylic acid derivative - Organoheterocyclic compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic oxide - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Alkyl halide - Alkyl fluoride - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as allocolchicine alkaloids. These are alkaloids with a structure based on the tricyclic allocolchicine skeleton, which consists of a dibenzocycloheptane where the cycloheptane moiety carries the N-acetamide group.
External Descriptors
Not available