Compound Identification
SMILES
O=C(NC1=CC(=CC(=C1)C(=O)OCC1=CC=CC=C1)C(=O)OCC1=CC=CC=C1)[C@@H](CC1=CC=CC=C1)NC(=O)[C@H]1[C@H](C2C3=CC=CC=C3C1C1=CC=CC=C21)C(=O)NCC12CC3CC(CC(C3)C1)C2
InChIKey
InChIKey=XQOBBVWQVRZQRB-ROQPEMRJSA-N
Formula
C60H57N3O7
Mass
932.13
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
Phenylalanine and derivatives Anthracenes m-Phthalate esters Acylaminobenzoic acid and derivatives Naphthalenecarboxamides N-acyl-alpha amino acids and derivatives Alpha amino acid amides M-phthalic acid and derivatives Tetralins Amphetamines and derivatives Benzoic acid esters Benzyloxycarbonyls Anilides Benzoyl derivatives N-arylamides Fatty amides Secondary carboxylic acid amides Carboxylic acid esters Carbonyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
1-aryltetralin lignan - Phenylalanine or derivatives - Anthracene - 2-naphthalenecarboxamide - Acylaminobenzoic acid or derivatives - 2-naphthalenecarboxylic acid or derivatives - N-acyl-alpha amino acid or derivatives - Phthalate ester - Meta-phthalic acid ester - Alpha-amino acid amide - Meta_phthalic_acid - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Benzoate ester - Tetralin - Benzyloxycarbonyl - Amphetamine or derivatives - Anilide - Benzoic acid or derivatives - N-arylamide - Benzoyl - Fatty amide - Benzenoid - Monocyclic benzene moiety - Fatty acyl - Carboxylic acid ester - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Aromatic homopolycyclic 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