Compound Identification
SMILES
CCOC(=O)[C@@H]([C@H](O)C1=CC(OC)=C(OC)C=C1)C(=C\C1=CC(OC)=C(OC)C=C1)\C(=O)OCC
InChIKey
InChIKey=DSWSWLMYDSRVGE-FAAVFHQWSA-N
Formula
C26H32O9
Mass
488.533
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Lignans, neolignans and related compounds
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
Coumaric acids and derivatives Cinnamic acid esters Dimethoxybenzenes Phenoxy compounds Anisoles Fatty acid esters Beta hydroxy acids and derivatives Alkyl aryl ethers Dicarboxylic acids and derivatives Enoate esters Secondary alcohols Organic oxides Hydrocarbon derivatives Carbonyl compounds Aromatic alcohols
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Norlignan skeleton - Coumaric acid or derivatives - Cinnamic acid or derivatives - Cinnamic acid ester - Dimethoxybenzene - O-dimethoxybenzene - Phenoxy compound - Phenol ether - Anisole - Methoxybenzene - Beta-hydroxy acid - Fatty acid ester - Alkyl aryl ether - Monocyclic benzene moiety - Hydroxy acid - Benzenoid - Fatty acyl - Dicarboxylic acid or derivatives - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Carboxylic acid ester - Secondary alcohol - Carboxylic acid derivative - Ether - Organic oxygen compound - Alcohol - Carbonyl group - Aromatic alcohol - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Aromatic homomonocyclic 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