Compound Identification
SMILES
O=C(CCN1CCCC1)NC1=CC2=CC(NC(=O)CCN3CCCC3)=CC3=C2C(=C1)C(=O)N(CCCN1CCN(CC1)C(=O)CCN1CCCC1)C3=O
InChIKey
InChIKey=OTLXGORCKBUXEG-UHFFFAOYSA-N
Formula
C40H56N8O5
Mass
728.939
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Isoquinolines and derivatives
- Subclass Isoquinolones and derivatives
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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
Beta amino acids and derivatives Naphthalenes N-arylamides N-alkylpiperazines N-substituted carboxylic acid imides N-alkylpyrrolidines Tertiary carboxylic acid amides Trialkylamines Secondary carboxylic acid amides Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Beta amino acid or derivatives - Isoquinolone - Naphthalene - N-arylamide - N-alkylpiperazine - 1,4-diazinane - Carboxylic acid imide, n-substituted - Piperazine - N-alkylpyrrolidine - Benzenoid - Tertiary carboxylic acid amide - Pyrrolidine - Carboxylic acid imide - Tertiary amine - Secondary carboxylic acid amide - Tertiary aliphatic amine - Carboxamide group - Amino acid or derivatives - Azacycle - Carboxylic acid derivative - Carbonyl group - Amine - Organic oxygen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic nitrogen 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