Compound Identification
SMILES
CS(O)(=O)=O.NCCOC1=CC2=C(OC(CC2=O)C2=CC=CC=C2)C=C1
InChIKey
InChIKey=QLIUTQHFQSEETB-UHFFFAOYSA-N
Formula
C18H21NO6S
Mass
379.43
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Flavonoids
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Subclass
Flavans
- Level 5 Flavanones
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Subclass
Flavans
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Class
Flavonoids
-
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
Chromones Phenol ethers Aryl alkyl ketones Alkyl aryl ethers Benzene and substituted derivatives Sulfonyls Organosulfonic acids Methanesulfonates Alkanesulfonic acids Oxacyclic compounds Organic oxides Monoalkylamines Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
Flavanone - Chromone - Chromane - Benzopyran - 1-benzopyran - Phenol ether - Aryl ketone - Aryl alkyl ketone - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Alkanesulfonic acid - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Methanesulfonate - Ketone - Oxacycle - Organoheterocyclic compound - Ether - Primary amine - Primary aliphatic amine - Organonitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organosulfur compound - Amine - 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