Compound Identification
SMILES
COC(=O)CC(C)C(=O)C1=C(OC)C(C(=O)OC)=C(C)C=C1
InChIKey
InChIKey=UBCUDSBORFDGIW-UHFFFAOYSA-N
Formula
C16H20O6
Mass
308.33
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 O-methoxybenzoic acids and derivatives Benzoic acid esters Phenylpropanes Anisoles Aryl alkyl ketones Benzoyl derivatives Phenoxy compounds Gamma-keto acids and derivatives Methoxybenzenes Fatty acid methyl esters Alkyl aryl ethers Toluenes Dicarboxylic acids and derivatives Methyl esters Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Alkyl-phenylketone - Butyrophenone - O-methoxybenzoic acid or derivatives - Benzoate ester - Phenylpropane - Benzoic acid or derivatives - Gamma-keto acid - Phenoxy compound - Phenol ether - Anisole - Aryl alkyl ketone - Methoxybenzene - Benzoyl - Fatty acid ester - Fatty acid methyl ester - Alkyl aryl ether - Toluene - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Keto acid - Dicarboxylic acid or derivatives - Methyl ester - Carboxylic acid ester - Carboxylic acid derivative - Ether - Organic oxide - Hydrocarbon derivative - 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