Compound Identification
SMILES
COC(=O)[C@@H]1[C@H](O[C@@](\C=C(/C#N)C2=CC=C(Cl)C=C2)([C@H]1C(=O)OC)C1=CC=CC=C1)C1=CC=C(Cl)C=C1
InChIKey
InChIKey=RZLFMCOYGNGJIM-HZHRPXOBSA-N
Formula
C29H23Cl2NO5
Mass
536.41
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Lignans, neolignans and related compounds
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Class
Furanoid lignans
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Subclass
Tetrahydrofuran lignans
- Level 5 7,7'-epoxylignans
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Subclass
Tetrahydrofuran lignans
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Class
Furanoid lignans
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Superclass
Lignans, neolignans and related compounds
Kingdom
Organic compounds
Superclass
Lignans, neolignans and related compounds
Class
Furanoid lignans
Subclass
Tetrahydrofuran lignans
Intermediate Tree Nodes
Not available
Direct Parent
7,7'-epoxylignans
Alternative Parents
Dibenzylbutane lignans Aromatic monoterpenoids Monocyclic monoterpenoids Styrenes Chlorobenzenes Aryl chlorides Dicarboxylic acids and derivatives Oxolanes Methyl esters Oxacyclic compounds Dialkyl ethers Nitriles Organic oxides Organochlorides Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
7,7p-epoxylignan - Dibenzylbutane lignan skeleton - Aromatic monoterpenoid - Monocyclic monoterpenoid - Monoterpenoid - Styrene - Chlorobenzene - Halobenzene - Benzenoid - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Methyl ester - Oxolane - Carboxylic acid ester - Oxacycle - Organoheterocyclic compound - Nitrile - Carbonitrile - Carboxylic acid derivative - Dialkyl ether - Ether - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Cyanide - Organic oxide - Carbonyl group - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as 7,7'-epoxylignans. These are lignans with a structure based on a 2,5-diaryl-3, 4-dimethyltetrahydrofuran skeleton.
External Descriptors
Not available