Compound Identification
SMILES
COC1=C(C(=O)C2=C(C(O)=O)C(O)=C(O)C=C2O1)C1=C(C=C2C(=O)C3=C(C(O)=O)C(O)=C(O)C=C3OC2=C1C(C)=O)C(C)=O
InChIKey
InChIKey=HYNJWQUNCFKEGY-UHFFFAOYSA-N
Formula
C29H18O15
Mass
606.448
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
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Class
Isoflavonoids
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Subclass
Isoflav-2-enes
- Level 5 Isoflavones
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Subclass
Isoflav-2-enes
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Class
Isoflavonoids
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Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Isoflavonoids
Subclass
Isoflav-2-enes
Intermediate Tree Nodes
Not available
Direct Parent
Isoflavones
Alternative Parents
Hydroxyisoflavonoids Xanthones 2-methoxychromones Coumarins and derivatives Salicylic acid and derivatives Acetophenones Aryl alkyl ketones 1-hydroxy-2-unsubstituted benzenoids Alkyl aryl ethers Pyranones and derivatives Vinylogous acids Vinylogous esters Heteroaromatic compounds Oxacyclic compounds Carboxylic acids Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Hydroxyisoflavonoid - Isoflavone - Xanthone - Dibenzopyran - Xanthene - 2-methoxychromone - Chromone - Coumarin - Benzopyran - Hydroxybenzoic acid - Salicylic acid or derivatives - 1-benzopyran - Acetophenone - Aryl ketone - Aryl alkyl ketone - Pyranone - Phenol - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Benzenoid - Pyran - Vinylogous ester - Heteroaromatic compound - Vinylogous acid - Ketone - Organoheterocyclic compound - Oxacycle - Carboxylic acid derivative - Carboxylic acid - Ether - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as isoflavones. These are polycyclic compounds containing a 2-isoflavene skeleton which bears a ketone group at the C4 carbon atom.
External Descriptors
Not available