Compound Identification
SMILES
[Ti+4].[OH2+]C1=CC2=C(OCO2)C=C1.[OH2+]C1=CC2=C(OCO2)C=C1.CC(=O)[CH+]C(=O)C1=CC=CC=C1.CC(=O)[CH+]C(=O)C1=CC=CC=C1
InChIKey
InChIKey=HYCFAFYNURNJAC-UHFFFAOYSA-P
Formula
C34H32O10Ti
Mass
648.483
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 Benzoyl derivatives Aryl ketones 1-hydroxy-2-unsubstituted benzenoids Oxacyclic compounds Organic transition metal salts Acetals Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Not available
Substituents
Butyrophenone - Benzodioxole - Benzoyl - Aryl ketone - 1-hydroxy-2-unsubstituted benzenoid - Ketone - Oxacycle - Organic transition metal salt - Organoheterocyclic compound - Acetal - Organic salt - Organooxygen compound - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Organic cation - 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