Compound Identification
SMILES
C[C@@H]1CC[C@H]2CC(=O)N(C)[C@@H]3O[C@]4(CC5=CC=CC=C5)CC[C@@H]1[C@@]23OO4
InChIKey
InChIKey=RUFRCETWTFIINE-CQAWWZBVSA-N
Formula
C21H27NO4
Mass
357.45
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Isoquinolines and derivatives
- Subclass Isoquinolones and derivatives
-
Class
Isoquinolines and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Isoquinolines and derivatives
Subclass
Isoquinolones and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Isoquinolones and derivatives
Alternative Parents
Azaspirodecane derivatives Piperidinones Oxepanes Delta lactams Trioxanes Benzene and substituted derivatives Tertiary carboxylic acid amides Dialkyl peroxides Oxacyclic compounds Azacyclic compounds Organonitrogen compounds Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoquinolone - Azaspirodecane - Delta-lactam - Oxepane - Piperidinone - Monocyclic benzene moiety - Piperidine - 1,2,4-trioxane - Benzenoid - Tertiary carboxylic acid amide - Lactam - Carboxamide group - Dialkyl peroxide - Oxacycle - Carboxylic acid derivative - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Carbonyl group - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as isoquinolones and derivatives. These are aromatic polycyclic compounds containing a ketone bearing isoquinoline moiety.
External Descriptors
Not available