Compound Identification
SMILES
COC1=CC=CC=C1\C=C\C(=O)N1C[C@@H]2[C@](C1)([C@H]1CC[C@]2(C2=CC3=C(OCC3)C=C2)C2=CC=CC=C12)C(=O)NCC1=CN=CC=C1
InChIKey
InChIKey=WCFWLNNGISOCFQ-YTMCWBCASA-N
Formula
C39H37N3O4
Mass
611.742
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
Naphthalenecarboxamides Coumaric acids and derivatives Tetralins Coumarans Isoindolines Anisoles Styrenes Methoxybenzenes N-acylpyrrolidines Pyrrolidinecarboxamides Phenoxy compounds Alkyl aryl ethers Pyridines and derivatives Heteroaromatic compounds Tertiary carboxylic acid amides Secondary carboxylic acid amides Azacyclic compounds Oxacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-aryltetralin lignan - 2-naphthalenecarboxamide - 2-naphthalenecarboxylic acid or derivatives - Cinnamic acid or derivatives - Coumaric acid or derivatives - Tetralin - Isoindole or derivatives - Coumaran - Isoindoline - Phenoxy compound - N-acylpyrrolidine - Anisole - Phenol ether - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-3-carboxamide - Styrene - Methoxybenzene - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Pyridine - Pyrrolidine - Tertiary carboxylic acid amide - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid derivative - Oxacycle - Azacycle - Ether - Organoheterocyclic compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organooxygen compound - 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