Compound Identification
SMILES
O=C(C1C(OC(=O)C1=O)C1OC(=O)C(=O)C1C(=O)C1=CC=CC=C1)C1=CC=CC=C1
InChIKey
InChIKey=GBNNXFMRUILMIN-UHFFFAOYSA-N
Formula
C22H14O8
Mass
406.346
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
Benzoyl derivatives Aryl alkyl ketones Beta-diketones Gamma butyrolactones Furanones Dicarboxylic acids and derivatives Oxolanes Cyclic ketones Carboxylic acid esters Oxacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alkyl-phenylketone - Benzoyl - Aryl alkyl ketone - 1,3-diketone - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - 3-furanone - Gamma butyrolactone - 1,3-dicarbonyl compound - Benzenoid - Oxolane - Lactone - Carboxylic acid ester - Cyclic ketone - Carboxylic acid derivative - Organoheterocyclic compound - Oxacycle - Organic oxide - Hydrocarbon derivative - Aromatic heteromonocyclic 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