Compound Identification
SMILES
COC(=O)C1[C@@H]2O[C@](C1C(=O)OC)(C1=CC(OC)=C(OC)C=C21)C1=CC(C)=C(OC)C(OC)=C1
InChIKey
InChIKey=QOMANTBECAPKFK-FQATZHFKSA-N
Formula
C25H28O9
Mass
472.49
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 Dimethoxybenzenes Isocoumarans Phenoxy compounds Anisoles Toluenes Alkyl aryl ethers Dicarboxylic acids and derivatives Oxolanes Methyl esters Dialkyl ethers Oxacyclic compounds Organic oxides Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-aryltetralin lignan - 2-naphthalenecarboxylic acid - 2-naphthalenecarboxylic acid or derivatives - Tetralin - Dimethoxybenzene - O-dimethoxybenzene - Isocoumaran - Methoxybenzene - Anisole - Phenol ether - Phenoxy compound - Toluene - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Dicarboxylic acid or derivatives - Methyl ester - Oxolane - Carboxylic acid ester - Ether - Dialkyl ether - Carboxylic acid derivative - Organoheterocyclic compound - Oxacycle - Organooxygen compound - Organic oxide - Carbonyl group - Hydrocarbon derivative - Organic oxygen 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