Compound Identification
SMILES
O[C@@]1([C@H](OC2=CC=CC=C2C1=O)C1=CC=C(C=C1)[N+]([O-])=O)C1=CC=C(C=C1)[N+]([O-])=O
InChIKey
InChIKey=DPQCVRQASGTBIG-RTWAWAEBSA-N
Formula
C21H14N2O7
Mass
406.35
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
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Class
Flavonoids
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Subclass
Flavans
- 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
Not available
Direct Parent
Flavanones
Alternative Parents
3-hydroxyflavonoids Isoflavanones Stilbenes Chromones Nitrobenzenes Aryl alkyl ketones Nitroaromatic compounds Alkyl aryl ethers Acyloins Tertiary alcohols Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Organic oxoazanium compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-hydroxyflavonoid - Flavanone - Hydroxyflavonoid - Isoflavanone - Isoflavan - Isoflavonoid skeleton - Isoflavonoid - Stilbene - Chromone - Chromane - Benzopyran - 1-benzopyran - Nitrobenzene - Nitroaromatic compound - Aryl alkyl ketone - Aryl ketone - Alkyl aryl ether - Benzenoid - Acyloin - Monocyclic benzene moiety - Tertiary alcohol - C-nitro compound - Ketone - Organic nitro compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organoheterocyclic compound - Oxacycle - Ether - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organic salt - Alcohol - Organic zwitterion - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as flavanones. 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 ketone at the carbon C3.
External Descriptors
Not available