Structure Information
Structure

Compound Identification

SMILES

COC(=O)C(CO)N\C=C1/C(=O)C(O)=C(C(C)C)C2=CC(C)=C(C(O)=C12)C1=C(C)C=C2C(C(C)C)=C(O)C(=O)\C(=C/NC(CO)C(=O)OC)C2=C1O

InChIKey

InChIKey=QGDGEUHEJXYIGX-IINORCHSSA-N

Formula

C38H44N2O12

Mass

720.772

Export to:

JSON SDF CSV

Taxonomic Classification

Taxonomy Tree

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

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

Neolignan skeleton - Sesquiterpenoid - Cadinane sesquiterpenoid - Alpha-amino acid ester - Serine or derivatives - Alpha-amino acid or derivatives - Naphthalene - 1-hydroxy-4-unsubstituted benzenoid - Beta-hydroxy acid - Phenol - Dicarboxylic acid or derivatives - Benzenoid - Hydroxy acid - Vinylogous amide - Methyl ester - Carboxylic acid ester - Cyclic ketone - Ketone - Enol - Enamine - Secondary aliphatic amine - Carboxylic acid derivative - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Alcohol - Carbonyl group - Organic oxide - Amine - Primary alcohol - Organooxygen compound - Organonitrogen 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

Previous Back Next