Compound Identification
SMILES
FC(F)(F)C1=C(C(=O)C2=C(O1)C=C(OC(=O)C1CCCN1C(=O)OCC1=CC=CC=C1)C=C2)C1=CC2=C(OCCO2)C=C1
InChIKey
InChIKey=MVAMXVMUMFXXJC-UHFFFAOYSA-N
Formula
C31H24F3NO8
Mass
595.527
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
Proline and derivatives Alpha amino acid esters Chromones Phenol esters Benzo-1,4-dioxanes Benzyloxycarbonyls Pyrrolidine carboxylic acids Pyranones and derivatives Alkyl aryl ethers Para dioxins Carbamate esters Heteroaromatic compounds Carboxylic acid esters Oxacyclic compounds Azacyclic compounds Monocarboxylic acids and derivatives Organic oxides Organofluorides Alkyl fluorides Organonitrogen compounds Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoflavone - Alpha-amino acid ester - Proline or derivatives - Chromone - Alpha-amino acid or derivatives - Benzo-1,4-dioxane - Benzodioxane - Benzopyran - Benzyloxycarbonyl - Phenol ester - 1-benzopyran - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine carboxylic acid - Pyranone - Alkyl aryl ether - Pyran - Para-dioxin - Benzenoid - Monocyclic benzene moiety - Carbamic acid ester - Pyrrolidine - Heteroaromatic compound - Carboxylic acid ester - Oxacycle - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Monocarboxylic acid or derivatives - Carbonyl group - Organofluoride - Organic nitrogen compound - Alkyl halide - Alkyl fluoride - Organonitrogen compound - Organohalogen compound - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - 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