Compound Identification
SMILES
COC1=CC(Br)=C2CN(CCC34C=C[C@H](O)CC3OC1=C24)C(=O)CCC(O)=O
InChIKey
InChIKey=GLNJVEWJVYAIHH-GZTUIPEVSA-N
Formula
C20H22BrNO6
Mass
452.301
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Amaryllidaceae alkaloids
Subclass
Galanthamine-type amaryllidaceae alkaloids
Intermediate Tree Nodes
Not available
Direct Parent
Galanthamine-type amaryllidaceae alkaloids
Alternative Parents
Benzazepines Coumarans Anisoles Alkyl aryl ethers Azepines Aryl bromides Tertiary carboxylic acid amides Secondary alcohols Monocarboxylic acids and derivatives Oxacyclic compounds Carboxylic acids Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Organobromides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Galanthamine-type amaryllidaceae alkaloid - Benzazepine - Coumaran - Anisole - Phenol ether - Alkyl aryl ether - Azepine - Aryl bromide - Aryl halide - Benzenoid - Tertiary carboxylic acid amide - Carboxamide group - Secondary alcohol - Oxacycle - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Alcohol - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as galanthamine-type amaryllidaceae alkaloids. These are amaryllidaceae alkaloids with a structure characterized a tetracyclic skeleton with two ortho aromatic protons in ring A.
External Descriptors
Not available