Compound Identification
SMILES
CCOC(=O)C1=NNC23C4C5=CC=CC=C5C(C5=CC=CC=C45)C12C(=O)N(C3=O)C1=CC=C(Cl)C=C1
InChIKey
InChIKey=HUBVDJKAYPNQDP-UHFFFAOYSA-N
Formula
C28H20ClN3O4
Mass
497.94
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lignans, neolignans and related compounds
- Class Aryltetralin lignans
-
Superclass
Lignans, neolignans and related compounds
Kingdom
Organic compounds
Superclass
Lignans, neolignans and related compounds
Class
Aryltetralin lignans
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Aryltetralin lignans
Alternative Parents
Anthracenes Phenylpyrrolidines Tetralins Alpha amino acids and derivatives Isoindolones Chlorobenzenes Pyrrolidine-2-ones N-substituted carboxylic acid imides Aryl chlorides Pyrroles Pyrazolines Dicarboximides N-alkylated hydrazones Carboxylic acid esters Lactams Azacyclic compounds Monocarboxylic acids and derivatives Organic oxides Carbonyl compounds Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-aryltetralin lignan - Anthracene - 1-phenylpyrrolidine - Alpha-amino acid or derivatives - Isoindolone - Tetralin - Isoindoline - Isoindole or derivatives - Chlorobenzene - Halobenzene - Monocyclic benzene moiety - Carboxylic acid imide, n-substituted - Aryl halide - Aryl chloride - Benzenoid - Pyrrolidone - 2-pyrrolidone - Dicarboximide - Pyrazoline - Pyrrole - Pyrrolidine - Carboxylic acid imide - Carboxylic acid ester - Lactam - N-alkylated hydrazone - Carboxylic acid derivative - Hydrazone - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Azacycle - Organooxygen compound - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Carbonyl group - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as aryltetralin lignans. These are lignans with a structure based on the 1-phenyltetralin skeleton.
External Descriptors
Not available