Compound Identification
SMILES
C[N+](C)(C)CCO.CCCOC1=CC=CC(C\C(C(=O)C2=CC=C(OC)C=C2)=C(\C([O-])=O)C2=CC3=C(OCO3)C=C2)=C1
InChIKey
InChIKey=YAONICLCIAJFBA-NYIQPMNJSA-M
Formula
C33H39NO8
Mass
577.674
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
-
Class
Linear 1,3-diarylpropanoids
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Subclass
Chalcones and dihydrochalcones
- Level 5 Retro-dihydrochalcones
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Subclass
Chalcones and dihydrochalcones
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Class
Linear 1,3-diarylpropanoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Linear 1,3-diarylpropanoids
Subclass
Chalcones and dihydrochalcones
Intermediate Tree Nodes
Not available
Direct Parent
Retro-dihydrochalcones
Alternative Parents
Retrochalcones Cinnamic acids and derivatives Butyrophenones Benzodioxoles Anisoles Aryl ketones Phenoxy compounds Benzoyl derivatives Methoxybenzenes Alkyl aryl ethers Cholines Alpha-branched alpha,beta-unsaturated ketones Enones Tetraalkylammonium salts Acryloyl compounds Carboxylic acid salts 1,2-aminoalcohols Acetals Carboxylic acids Oxacyclic compounds Monocarboxylic acids and derivatives Organic oxides Organopnictogen compounds Primary alcohols Aldehydes Hydrocarbon derivatives Organic cations
Molecular Framework
Not available
Substituents
Retro-dihydrochalcone - Retrochalcone - Cinnamic acid or derivatives - Butyrophenone - Benzodioxole - Phenoxy compound - Anisole - Benzoyl - Methoxybenzene - Phenol ether - Aryl ketone - Alkyl aryl ether - Choline - Monocyclic benzene moiety - Alpha-branched alpha,beta-unsaturated-ketone - Benzenoid - Acryloyl-group - Tetraalkylammonium salt - Enone - Alpha,beta-unsaturated ketone - Quaternary ammonium salt - Carboxylic acid salt - 1,2-aminoalcohol - Ketone - Alkanolamine - Acetal - Carboxylic acid derivative - Carboxylic acid - Oxacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Ether - Hydrocarbon derivative - Aldehyde - Organic oxide - Organopnictogen compound - Organic oxygen compound - Carbonyl group - Primary alcohol - Organonitrogen compound - Alcohol - Organooxygen compound - Organic nitrogen compound - Amine - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as retro-dihydrochalcones. These are a form of normal dihydrochalcones that are structurally distinguished by the lack of oxygen functionalities at the C2'- and C6'-positions.
External Descriptors
Not available