Compound Identification
SMILES
OC[C@H]1[C@H](CO[C@@H]1C1=CC2=C(OCO2)C=C1)C(=O)C1=CC2=C(OCO2)C=C1
InChIKey
InChIKey=RZIWMSJDPYUACC-PJSUUKDQSA-N
Formula
C20H18O7
Mass
370.357
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 7,9'-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
7,9'-epoxylignans
Alternative Parents
Benzodioxoles Aryl alkyl ketones Benzenoids Oxolanes Oxacyclic compounds Dialkyl ethers Acetals Primary alcohols Organic oxides Hydrocarbon derivatives Aldehydes
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
7,9p-epoxylignan - Benzodioxole - Aryl alkyl ketone - Aryl ketone - Benzenoid - Oxolane - Ketone - Acetal - Dialkyl ether - Ether - Oxacycle - Organoheterocyclic compound - Organic oxide - Aldehyde - Alcohol - Organooxygen compound - Hydrocarbon derivative - Primary alcohol - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 7,9'-epoxylignans. These are lignans that contain the 7,9'-epoxylignan skeleton, which consists of a tetrahydrofuran that carries a phenyl group, a methyl group, and a benzyl group at the 2-, 3-, 4-position, respectively.
External Descriptors
Not available