Compound Identification
SMILES
OC[C@H]1O[C@@](O)(CC(=O)C2=CC=CC=C2)[C@H](O)[C@H]1O
InChIKey
InChIKey=JEHLMKYDBMOFEN-XQHKEYJVSA-N
Formula
C13H16O6
Mass
268.265
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
C-glycosyl compounds Pentoses Benzoyl derivatives Aryl alkyl ketones Beta-hydroxy ketones Oxolanes Secondary alcohols Hemiacetals Polyols Oxacyclic compounds Primary alcohols Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alkyl-phenylketone - C-glycosyl compound - Glycosyl compound - Pentose monosaccharide - Benzoyl - Aryl alkyl ketone - Monocyclic benzene moiety - Beta-hydroxy ketone - Monosaccharide - Benzenoid - Oxolane - Hemiacetal - Secondary alcohol - Oxacycle - Polyol - Organoheterocyclic compound - Alcohol - Hydrocarbon derivative - Organic oxide - Primary alcohol - 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