Compound Identification
SMILES
COC1CC2N(C)C(=O)C3N(CCC4=CC(O)C(O)(O)C=C4)C(=O)C4=C(C=C5OCOC5=C4)C23C=C1
InChIKey
InChIKey=XHFCFIXNVYFEFU-UHFFFAOYSA-N
Formula
C26H28N2O8
Mass
496.516
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
Tetrahydroisoquinolines Alpha amino acids and derivatives Benzodioxoles Indoles and derivatives Pyrrolidine-2-ones Benzenoids N-alkylpyrrolidines Tertiary carboxylic acid amides Secondary alcohols Lactams Acetals Polyols Azacyclic compounds Oxacyclic compounds Carbonyl hydrates Dialkyl ethers Organopnictogen compounds Carbonyl compounds Hydrocarbon derivatives Organonitrogen compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoquinolone - Alpha-amino acid or derivatives - Tetrahydroisoquinoline - Benzodioxole - Indole or derivatives - Benzenoid - N-alkylpyrrolidine - 2-pyrrolidone - Pyrrolidone - Pyrrolidine - Tertiary carboxylic acid amide - Carboxamide group - Lactam - Secondary alcohol - Acetal - Carbonyl hydrate - Carboxylic acid derivative - Dialkyl ether - Ether - Oxacycle - Polyol - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organonitrogen compound - Organooxygen compound - Alcohol - Organopnictogen compound - 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