Compound Identification
SMILES
CC(=O)OC1=CC(OC(C)=O)=C(Br)C2=C1[C@]13CCN(C=O)[C@H](C2)[C@@H]1CCC(=O)C3
InChIKey
InChIKey=RPAPLXGAEUWFKO-MRUHUIDDSA-N
Formula
C21H22BrNO6
Mass
464.312
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
- Class Morphinans
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Morphinans
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Morphinans
Alternative Parents
Phenanthrenes and derivatives Benzazocines Isoquinolones and derivatives Tetralins Piperidines Dicarboxylic acids and derivatives Tertiary carboxylic acid amides Enol esters Cyclic ketones Vinyl bromides Bromoalkenes Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organobromides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Morphinan - Phenanthrene - Benzazocine - Isoquinolone - Tetralin - Benzenoid - Piperidine - Dicarboxylic acid or derivatives - Tertiary carboxylic acid amide - Enol ester - Cyclic ketone - Ketone - Carboxylic acid ester - Carboxamide group - Azacycle - Bromoalkene - Haloalkene - Organoheterocyclic compound - Vinyl halide - Vinyl bromide - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as morphinans. These are polycyclic compounds with a four-ring skeleton with three condensed six-member rings forming a partially hydrogenated phenanthrene moiety, one of which is aromatic while the two others are alicyclic.
External Descriptors
Not available