Compound Identification
SMILES
COC1=C(C=CC(NC(N)=NC(=O)\C=C\C2=CC=CO2)=C1)C1=CC2=CC=CC=C2OC1=O
InChIKey
InChIKey=IPBYGSPYWNJNSO-PKNBQFBNSA-N
Formula
C24H19N3O5
Mass
429.432
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
Isoflav-3-enes
- Level 5 Isoflav-3-enones
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Subclass
Isoflav-3-enes
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Class
Isoflavonoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Isoflavonoids
Subclass
Isoflav-3-enes
Intermediate Tree Nodes
Not available
Direct Parent
Isoflav-3-enones
Alternative Parents
Coumarins and derivatives 1-benzopyrans Methoxyanilines Methoxybenzenes Anisoles Phenoxy compounds Acylguanidines Alkyl aryl ethers Pyranones and derivatives Heteroaromatic compounds Furans N-acylimines Lactones Oxacyclic compounds Propargyl-type 1,3-dipolar organic compounds Carboxylic acids and derivatives Carboximidamides Carbonyl compounds Hydrocarbon derivatives Organic oxides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoflav-3-enone skeleton - Coumarin - Benzopyran - 1-benzopyran - Methoxyaniline - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Acylguanidine - Alkyl aryl ether - Pyranone - Monocyclic benzene moiety - Pyran - Benzenoid - Heteroaromatic compound - Furan - N-acylimine - Lactone - Guanidine - Carboximidamide - Propargyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Oxacycle - Organic 1,3-dipolar compound - Carboxylic acid derivative - Ether - Organic oxygen compound - Hydrocarbon derivative - Organonitrogen compound - Carbonyl group - Organic oxide - Organic nitrogen compound - Organooxygen compound - Organopnictogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as isoflav-3-enones. These are flavonoids with a structure based on an isoflav-3-ene skeleton bearing an oxo-group at position C2.
External Descriptors
Not available