Compound Identification
SMILES
OC1=C2O[C@H]3C[C@@H](OC(=O)NC4=CC=CC=C4)C=C[C@]33CCN(CC4=CC=CC=C4)CC(C=C1)=C23
InChIKey
InChIKey=KKRCLFGNQCQDDF-KULFAVDPSA-N
Formula
C29H28N2O4
Mass
468.553
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
Phenylcarbamic acid esters Benzazepines Coumarans Phenylmethylamines Benzylamines 1-hydroxy-2-unsubstituted benzenoids Alkyl aryl ethers Aralkylamines Azepines Carbamate esters Trialkylamines Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Galanthamine-type amaryllidaceae alkaloid - Phenylcarbamic acid ester - Benzazepine - Coumaran - Benzylamine - Phenylmethylamine - Alkyl aryl ether - 1-hydroxy-2-unsubstituted benzenoid - Azepine - Phenol - Aralkylamine - Monocyclic benzene moiety - Benzenoid - Carbamic acid ester - Tertiary aliphatic amine - Tertiary amine - Oxacycle - Ether - Azacycle - Organoheterocyclic compound - Amine - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic oxygen 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