Compound Identification
SMILES
C.COC1=C(OC)C2=C3C(CC22C=CC(=O)C=C2)[NH2+]CCC3=C1.COC1=C(OC)C2=C3C(CC22C=CC(=O)C=C2)[NH2+]CCC3=C1
InChIKey
InChIKey=BRNZBXHQXVKYIU-UHFFFAOYSA-P
Formula
C37H44N2O6
Mass
612.766
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
- Class Proaporphines
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Proaporphines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Proaporphines
Alternative Parents
Tetrahydroisoquinolines Indanes Anisoles Aralkylamines Alkyl aryl ethers Quaternary ammonium salts Cyclic ketones Dialkylamines Azacyclic compounds Organic oxides Hydrocarbon derivatives Saturated hydrocarbons Organic cations
Molecular Framework
Not available
Substituents
Proaporphine - Tetrahydroisoquinoline - Indane - Anisole - Phenol ether - Alkyl aryl ether - Aralkylamine - Benzenoid - Quaternary ammonium salt - Cyclic ketone - Ketone - Organoheterocyclic compound - Azacycle - Secondary amine - Secondary aliphatic amine - Ether - Amine - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Hydrocarbon derivative - Saturated hydrocarbon - Organic cation - Hydrocarbon - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as proaporphines. These are benzylisoquinoline derivatives characterized by the presence of a spirocyclohexane ring that can occur in various oxidation levels, from cyclohexadienone to cyclohexanol.
External Descriptors
Not available