Compound Identification
SMILES
COC1=C(OC)C2=C3[C@@H](CC22C=CC(=O)C=C2)[N@@+](C)([O-])CCC3=C1
InChIKey
InChIKey=VHJCVOBUYYKUCN-VLIAUNLRSA-N
Formula
C19H21NO4
Mass
327.38
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 Alkyl aryl ethers Trialkyl amine oxides Cyclic ketones Trisubstituted amine oxides and derivatives Azacyclic compounds Organic salts Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Proaporphine - Tetrahydroisoquinoline - Indane - Anisole - Phenol ether - Alkyl aryl ether - Benzenoid - Trialkyl amine oxide - Ketone - Cyclic ketone - N-oxide - Ether - Azacycle - Organoheterocyclic compound - Trisubstituted n-oxide - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic salt - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - Organic cation - 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