Compound Identification
SMILES
OC(CC(=O)C1=CC2=C(OCO2)C=C1)C(O)=O
InChIKey
InChIKey=FHPGAVJHVGTMET-UHFFFAOYSA-N
Formula
C11H10O6
Mass
238.195
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Butyrophenones
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Butyrophenones
Intermediate Tree Nodes
Not available
Direct Parent
Butyrophenones
Alternative Parents
Benzodioxoles Gamma-keto acids and derivatives Aryl alkyl ketones Beta-hydroxy ketones Alpha hydroxy acids and derivatives Secondary alcohols Oxacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Acetals Organic oxides Hydrocarbon derivatives Aldehydes
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Butyrophenone - Benzodioxole - Gamma-keto acid - Aryl ketone - Aryl alkyl ketone - Alpha-hydroxy acid - Beta-hydroxy ketone - Hydroxy acid - Keto acid - Ketone - Secondary alcohol - Monocarboxylic acid or derivatives - Acetal - Carboxylic acid - Carboxylic acid derivative - Oxacycle - Organoheterocyclic compound - Aldehyde - Hydrocarbon derivative - Carbonyl group - Organic oxide - Alcohol - Organic oxygen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as butyrophenones. These are compounds containing 1-phenylbutan-1-one moiety.
External Descriptors
Not available