Compound Identification
SMILES
CCOC(=O)CCC(=O)C1=CC(OC(=O)OCC)=C(OCC(O)CNC(C)(C)C)C=C1
InChIKey
InChIKey=HLJUCVXXNMHFLU-UHFFFAOYSA-N
Formula
C22H33NO8
Mass
439.505
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbonyl compounds
-
Level 5
Ketones
-
Level 6
Aryl ketones
-
Level 7
Phenylketones
- Level 8 Alkyl-phenylketones
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Level 7
Phenylketones
-
Level 6
Aryl ketones
-
Level 5
Ketones
-
Subclass
Carbonyl compounds
-
Class
Organooxygen compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Carbonyl compounds
Intermediate Tree Nodes
Ketones - Aryl ketones - Phenylketones
Direct Parent
Alkyl-phenylketones
Alternative Parents
Butyrophenones Phenoxy compounds Phenol ethers Gamma-keto acids and derivatives Aryl alkyl ketones Benzoyl derivatives Alkyl aryl ethers Fatty acid esters Carbonic acid diesters Secondary alcohols 1,2-aminoalcohols Amino acids and derivatives Carboxylic acid esters Monocarboxylic acids and derivatives Dialkylamines Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Alkyl-phenylketone - Butyrophenone - Benzoyl - Gamma-keto acid - Phenol ether - Aryl alkyl ketone - Phenoxy compound - Alkyl aryl ether - Fatty acid ester - Benzenoid - Fatty acyl - Monocyclic benzene moiety - Carbonic acid diester - Keto acid - Amino acid or derivatives - Secondary alcohol - 1,2-aminoalcohol - Carboxylic acid ester - Carbonic acid derivative - Secondary amine - Carboxylic acid derivative - Secondary aliphatic amine - Ether - Monocarboxylic acid or derivatives - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Amine - Alcohol - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group.
External Descriptors
Not available