Compound Identification
SMILES
OC(=O)[C@H]1[C@H](C(O)=O)[C@@]2(C(=O)[C@]1(C1=C2C2=CC=CC=C2C2=CC=CC=C12)C1=CC=CC=C1)C1=CC=CC=C1
InChIKey
InChIKey=QZXSTPXYPXQAIP-CUTKCQJKSA-N
Formula
C33H22O5
Mass
498.534
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
Aryltetralin lignans
- Subclass 9,9p-dihydroxyaryltetralin lignans
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Class
Aryltetralin lignans
-
Superclass
Lignans, neolignans and related compounds
Kingdom
Organic compounds
Superclass
Lignans, neolignans and related compounds
Class
Aryltetralin lignans
Subclass
9,9p-dihydroxyaryltetralin lignans
Intermediate Tree Nodes
Not available
Direct Parent
9,9p-dihydroxyaryltetralin lignans
Alternative Parents
Dibenzylbutane lignans Phenanthrenes and derivatives Naphthalenecarboxylic acids Indanones Tetralins Dicarboxylic acids and derivatives Benzene and substituted derivatives Ketones Carboxylic acids Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
9,9p-dihydroxyaryltetralin lignan - Dibenzylbutane lignan skeleton - Phenanthrene - 2-naphthalenecarboxylic acid - 2-naphthalenecarboxylic acid or derivatives - Indanone - Tetralin - Naphthalene - Indane - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Benzenoid - Ketone - Carboxylic acid - Carboxylic acid derivative - Organic oxide - Organooxygen compound - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as 9,9p-dihydroxyaryltetralin lignans. These are lignans with a structure based on the 1-phenyltetralin skeleton carrying a hydroxyl group at the 9- and the 9'- position.
External Descriptors
Not available