Compound Identification
SMILES
COC1=CC2=C(C=C1)C1C(CO2)C2=CC(NC(=O)C3=CC=CC=C3)=C(OCC3=CC=CC=C3)C=C2N1S(=O)(=O)C1=CC=CC=C1
InChIKey
InChIKey=SQJUEMFBYJYZCG-UHFFFAOYSA-N
Formula
C36H30N2O6S
Mass
618.7
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
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Class
Isoflavonoids
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Subclass
Isoflavans
- Level 5 Isoflavanols
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Subclass
Isoflavans
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Class
Isoflavonoids
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Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Isoflavonoids
Subclass
Isoflavans
Intermediate Tree Nodes
Not available
Direct Parent
Isoflavanols
Alternative Parents
1-benzopyrans Benzenesulfonamides Indoles and derivatives Benzenesulfonyl compounds Benzamides Anisoles Benzoyl derivatives Alkyl aryl ethers Organosulfonamides Sulfonyls Secondary carboxylic acid amides Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoflavanol - Benzenesulfonamide - Chromane - Benzopyran - 1-benzopyran - Benzamide - Benzenesulfonyl group - Benzoic acid or derivatives - Indole or derivatives - Anisole - Benzoyl - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Organosulfonic acid amide - Sulfonyl - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Secondary carboxylic acid amide - Carboxamide group - Oxacycle - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organopnictogen compound - Organic oxide - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as isoflavanols. These are polycyclic compounds containing a hydroxylated isoflavan skeleton.
External Descriptors
Not available