Compound Identification
SMILES
CC(C)(C)NC(=O)C1=CC=CC=C1C[C@@H](O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CC(N)=O)NC(=O)C1=CC2=CC=CC=C2C=C1
InChIKey
InChIKey=QGPPZHWTMZBHGO-RWSKJCERSA-N
Formula
C36H40N4O5
Mass
608.739
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Lignans, neolignans and related compounds
Kingdom
Organic compounds
Superclass
Lignans, neolignans and related compounds
Class
Not available
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Lignans, neolignans and related compounds
Alternative Parents
Asparagine and derivatives N-acyl-alpha amino acids and derivatives Naphthalenecarboxamides Alpha amino acid amides Amphetamines and derivatives Benzamides Benzoyl derivatives N-acyl amines Secondary carboxylic acid amides Primary carboxylic acid amides Secondary alcohols Organonitrogen compounds Hydrocarbon derivatives Carbonyl compounds Organopnictogen compounds Organic oxides
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Norlignan skeleton - Asparagine or derivatives - N-acyl-alpha amino acid or derivatives - 2-naphthalenecarboxamide - 2-naphthalenecarboxylic acid or derivatives - Alpha-amino acid amide - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Amphetamine or derivatives - Naphthalene - Benzamide - Benzoic acid or derivatives - Benzoyl - Benzenoid - Fatty acyl - N-acyl-amine - Monocyclic benzene moiety - Fatty amide - Primary carboxylic acid amide - Secondary alcohol - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid derivative - Organonitrogen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Alcohol - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organooxygen compound - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as lignans, neolignans and related compounds. These are plant products of low molecular weight formed primarily from oxidative coupling of two p-propylphenol moieties. They can also be described as micromolecules with two phenylpropanoid units coupled together. They can be attached in various manners, like C5-C5', C8-C8'. Most known natural lignans are oxidized at C9 and C9´ and, based upon the way in which oxygen is incorporated into the skeleton and on the cyclization patterns, a wide range of lignans of very different structural types can be formed.
External Descriptors
Not available