Compound Identification
SMILES
COC(=O)[C@H]1[C@H]([C@@H](C2=CC=CC=C2)C2=CC=CC=C2[C@H]1C(O)=O)C(=O)OC
InChIKey
InChIKey=NQCSPGIFKTXIFQ-XWTMOSNGSA-N
Formula
C21H20O6
Mass
368.385
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
Naphthalenecarboxylic acids Tetralins Tricarboxylic acids and derivatives Benzene and substituted derivatives Methyl esters Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
1-aryltetralin lignan - 2-naphthalenecarboxylic acid - 1-naphthalenecarboxylic acid - 1-naphthalenecarboxylic acid or derivatives - 2-naphthalenecarboxylic acid or derivatives - Tetralin - Tricarboxylic acid or derivatives - Benzenoid - Monocyclic benzene moiety - Methyl ester - Carboxylic acid ester - Carboxylic acid - Carboxylic acid derivative - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Carbonyl group - 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