Compound Identification
SMILES
COC1=C(C(=O)CC(O)C2=CC=CC=C2)C(OC)=C2OCOC2=C1
InChIKey
InChIKey=OZQWBGZVPYGMPN-UHFFFAOYSA-N
Formula
C18H18O6
Mass
330.336
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 Aryl alkyl ketones Anisoles Alkyl aryl ethers Beta-hydroxy ketones Secondary alcohols Oxacyclic compounds Acetals Organic oxides Hydrocarbon derivatives Aromatic alcohols Aldehydes
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Butyrophenone - Benzodioxole - Anisole - Aryl alkyl ketone - Aryl ketone - Alkyl aryl ether - Beta-hydroxy ketone - Ketone - Secondary alcohol - Acetal - Ether - Organoheterocyclic compound - Oxacycle - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aldehyde - Alcohol - Aromatic alcohol - 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
LIPIDMAPS (LMPK12120589) : Chalcones and dihydrochalcones