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](CS(=O)(=O)C1=CC=CC2=CC=CC=C12)NS(C)(=O)=O
InChIKey
InChIKey=IMYRTZBIRLSPFG-OJDZSJEKSA-N
Formula
C35H41N3O7S2
Mass
679.85
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
Alpha amino acid amides Amphetamines and derivatives Naphthalenes Benzamides Benzoyl derivatives Organosulfonamides Organic sulfonamides Sulfones Aminosulfonyl compounds Secondary alcohols Secondary carboxylic acid amides Organic oxides Organopnictogen compounds Hydrocarbon derivatives Carbonyl compounds Organonitrogen compounds
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Norlignan skeleton - Alpha-amino acid amide - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Amphetamine or derivatives - Naphthalene - Benzamide - Benzoic acid or derivatives - Benzoyl - Monocyclic benzene moiety - Benzenoid - Organosulfonic acid amide - Organic sulfonic acid amide - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Sulfone - Aminosulfonyl compound - Sulfonyl - Secondary carboxylic acid amide - Secondary alcohol - Carboxamide group - Carboxylic acid derivative - Organosulfur compound - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Alcohol - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organooxygen compound - Organopnictogen 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