Compound Identification
SMILES
COC1(O)C(C)=C(O)C(CC2=C(O)C(C(=O)CC(C)C)=C(O)C(C=O)=C2O)=C(O)C1(O)C(=O)C(C)C
InChIKey
InChIKey=HJXQLPJZZXXIBH-UHFFFAOYSA-N
Formula
C25H32O11
Mass
508.52
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
-
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
Butyrophenones Acylphloroglucinols and derivatives Hydroxybenzaldehydes Benzoyl derivatives Aryl alkyl ketones Cyclitols and derivatives Vinylogous acids Tertiary alcohols Alpha-hydroxy ketones Hemiacetals Polyols Enols Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Alkyl-phenylketone - Acylphloroglucinol derivative - Butyrophenone - Hydroxybenzaldehyde - Benzenetriol - Phloroglucinol derivative - Benzaldehyde - Aryl alkyl ketone - Benzoyl - Aryl-aldehyde - Phenol - Cyclitol or derivatives - Monocyclic benzene moiety - Benzenoid - Tertiary alcohol - Vinylogous acid - Alpha-hydroxy ketone - Hemiacetal - Enol - Polyol - Aldehyde - Alcohol - Hydrocarbon derivative - Organic oxide - 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