Compound Identification
SMILES
COC1=C(C)C(O)=C(CC2=C(O)C(C=O)=C(O)C(O)(C(=O)CC(C)C)C2(O)O)C(O)=C1C(=O)C(C)C
InChIKey
InChIKey=MMBHHZVMTLPUOC-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
Methoxyphenols Phenylpropanes Anisoles Aryl alkyl ketones Benzoyl derivatives Methoxybenzenes Ortho cresols Para cresols Phenoxy compounds Resorcinols Toluenes Alkyl aryl ethers Cyclitols and derivatives Vinylogous acids Alpha-hydroxy ketones Tertiary alcohols Enols Carbonyl hydrates Polyols Hydrocarbon derivatives Organic oxides Aldehydes
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Alkyl-phenylketone - Methoxyphenol - Phenylpropane - Phenoxy compound - Anisole - Methoxybenzene - Benzoyl - Aryl alkyl ketone - O-cresol - Resorcinol - P-cresol - Phenol ether - Alkyl aryl ether - Toluene - Phenol - Cyclitol or derivatives - Monocyclic benzene moiety - Benzenoid - Vinylogous acid - Alpha-hydroxy ketone - Tertiary alcohol - Ether - Enol - Carbonyl hydrate - Polyol - Aldehyde - Hydrocarbon derivative - Alcohol - 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