Compound Identification
SMILES
CCCN(C(C)=O)C1=CC=C(C=C1)C(=O)CC(=O)C1=C(C=CC=C1OC1CCCCO1)N(C(=O)OCC)C(=O)C(C)(C)C
InChIKey
InChIKey=VJNSTSMAQPSLNF-UHFFFAOYSA-N
Formula
C33H42N2O8
Mass
594.705
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
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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
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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
Alkyl-phenylketones Phenylcarbamic acid esters Butyrophenones Acetanilides Phenoxy compounds Phenol ethers Aryl alkyl ketones Benzoyl derivatives Beta-diketones Oxanes Acetamides Tertiary carboxylic acid amides Carbamate esters Dicarboximides Oxacyclic compounds Acetals Organonitrogen compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives Aldehydes
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Retro-dihydrochalcone - Alkyl-phenylketone - Phenylcarbamic acid ester - Butyrophenone - Acetanilide - Anilide - Phenylketone - Phenol ether - Phenoxy compound - Aryl alkyl ketone - Aryl ketone - Benzoyl - 1,3-diketone - Benzenoid - Monocyclic benzene moiety - 1,3-dicarbonyl compound - Oxane - Dicarboximide - Acetamide - Carbamic acid ester - Tertiary carboxylic acid amide - Carboxamide group - Ketone - Acetal - Carboxylic acid derivative - Oxacycle - Organoheterocyclic compound - Aldehyde - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic 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