Compound Identification
SMILES
Br.C[N+](C)(C)CC(=O)C1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1
InChIKey
InChIKey=UQMXLBVWXKFDGK-UHFFFAOYSA-N
Formula
C21H21BrNO
Mass
383.308
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
- Class 6,6a-secoaporphines
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
6,6a-secoaporphines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
6,6a-secoaporphines
Alternative Parents
Pyrenes Phenanthrenes and derivatives Naphthalenes Aryl alkyl ketones Tetraalkylammonium salts Alpha-amino ketones Organic oxides Hydrocarbon derivatives Hydrobromides Amines Organic cations
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
6,6a-secoaporphine - Pyrene - Phenanthrene - Naphthalene - Aryl alkyl ketone - Aryl ketone - Benzenoid - Alpha-aminoketone - Tetraalkylammonium salt - Quaternary ammonium salt - Ketone - Organic nitrogen compound - Amine - Hydrobromide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Organic cation - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as 6,6a-secoaporphines. These are alkaloids with a structure that contains an aminoethylphenanthrene moiety.
External Descriptors
Not available