Compound Identification
SMILES
COC(=O)CCC(=O)OCCOC1=CC=CC(=C1)C(=O)C(C)(C)O
InChIKey
InChIKey=FELWCRLTMSNYNL-UHFFFAOYSA-N
Formula
C17H22O7
Mass
338.356
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
Phenylpropanes Phenoxy compounds Phenol ethers Benzoyl derivatives Aryl alkyl ketones Fatty acid methyl esters Alkyl aryl ethers Dicarboxylic acids and derivatives Acyloins Tertiary alcohols Methyl esters Alpha-hydroxy ketones Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Alkyl-phenylketone - Phenylpropane - Benzoyl - Phenol ether - Phenoxy compound - Aryl alkyl ketone - Fatty acid ester - Fatty acid methyl ester - Alkyl aryl ether - Fatty acyl - Monocyclic benzene moiety - Acyloin - Dicarboxylic acid or derivatives - Benzenoid - Alpha-hydroxy ketone - Methyl ester - Tertiary alcohol - Carboxylic acid ester - Carboxylic acid derivative - Ether - Organic oxide - Hydrocarbon derivative - 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