Compound Identification
SMILES
CCCCCC(=O)OC1=C(C(=O)CCCCC)C(C(=O)OCC2=CC=CC=C2)=C(C(=O)CCCCC)C(O)=C1O
InChIKey
InChIKey=LABFGLUJHLLNKL-UHFFFAOYSA-N
Formula
C32H42O8
Mass
554.68
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
Gallic acid and derivatives p-Hydroxybenzoic acid alkyl esters m-Hydroxybenzoic acid esters Butyrophenones Phenol esters Benzyloxycarbonyls Phenoxy compounds Aryl alkyl ketones Benzoyl derivatives Catechols Fatty acid esters Vinylogous acids Carboxylic acid esters Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Alkyl-phenylketone - Gallic acid or derivatives - P-hydroxybenzoic acid alkyl ester - M-hydroxybenzoic acid ester - P-hydroxybenzoic acid ester - Dihydroxybenzoic acid - Butyrophenone - Phenol ester - Benzoate ester - Benzyloxycarbonyl - Benzoic acid or derivatives - Phenoxy compound - Catechol - Aryl alkyl ketone - Benzoyl - Phenol - Fatty acid ester - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Vinylogous acid - Carboxylic acid ester - Carboxylic acid derivative - Monocarboxylic acid or derivatives - 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