Compound Identification
SMILES
CCOC(=O)\C(=C\C1=CC(OC)=C(OC)C(OC)=C1)\C(=C/C1=CC(OC)=C(OC)C(OC)=C1)\C(=O)OC(C(=O)OC)C1=CC=CC=C1
InChIKey
InChIKey=AUGAIJMQCWDHSW-FEZYOMQXSA-N
Formula
C35H38O12
Mass
650.677
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 Benzyloxycarbonyls Tricarboxylic acids and derivatives Phenoxy compounds Methoxybenzenes Anisoles Fatty acid esters Alkyl aryl ethers Methyl esters Enoate esters Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Norlignan skeleton - Cinnamic acid or derivatives - Coumaric acid or derivatives - Cinnamic acid ester - Benzyloxycarbonyl - Tricarboxylic acid or derivatives - Methoxybenzene - Phenol ether - Phenoxy compound - Anisole - Fatty acid ester - Alkyl aryl ether - Fatty acyl - Benzenoid - Monocyclic benzene moiety - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl ester - Carboxylic acid ester - Carboxylic acid derivative - Ether - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - 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