Compound Identification
SMILES
[Al+3].OC1C(OC2=C(C([O-])=CC(O)=C2)C1=O)C1=C(O)C=C(O)C=C1.OC1C(OC2=C(C([O-])=CC(O)=C2)C1=O)C1=C(O)C=C(O)C=C1.OC1C(OC2=C(C([O-])=CC(O)=C2)C1=O)C1=C(O)C=C(O)C=C1
InChIKey
InChIKey=ZSSDPZRYGKFBOZ-UHFFFAOYSA-K
Formula
C45H33AlO21
Mass
936.72
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
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Class
Flavonoids
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Subclass
Flavans
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Level 5
Flavanones
- Level 6 Flavanonols
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Level 5
Flavanones
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Subclass
Flavans
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Class
Flavonoids
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Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Flavonoids
Subclass
Flavans
Intermediate Tree Nodes
Flavanones
Direct Parent
Flavanonols
Alternative Parents
3-hydroxyflavonoids 4'-hydroxyflavonoids 7-hydroxyflavonoids Chromones Resorcinols Aryl alkyl ketones Phenoxides 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Alkyl aryl ethers Vinylogous acids Secondary alcohols Oxacyclic compounds Organic aluminium salts Organic oxides Organic zwitterions Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
3-hydroxyflavonoid - 4'-hydroxyflavonoid - 7-hydroxyflavonoid - Flavanonol - Hydroxyflavonoid - Chromone - Chromane - Benzopyran - 1-benzopyran - Resorcinol - Aryl ketone - Aryl alkyl ketone - 1-hydroxy-2-unsubstituted benzenoid - 1-hydroxy-4-unsubstituted benzenoid - Phenoxide - Phenol - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Vinylogous acid - Secondary alcohol - Ketone - Organoheterocyclic compound - Ether - Oxacycle - Organic salt - Hydrocarbon derivative - Organic oxide - Organic aluminium salt - Organooxygen compound - Alcohol - Organic zwitterion - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as flavanonols. These are compounds containing a flavan-3-one moiety, with a structure characterized by a 2-phenyl-3,4-dihydro-2H-1-benzopyran bearing a hydroxyl group and a ketone at the carbon C2 and C3, respectively.
External Descriptors
Not available