Compound Identification
SMILES
COC1=CC=CC=C1C1OCC2OC(OC3=C(OC)C=C(C=C3)C(C)=O)C(NC(C)=O)C(OCC(O)=O)C2O1
InChIKey
InChIKey=BDBCHELWESQZBS-UHFFFAOYSA-N
Formula
C27H31NO11
Mass
545.541
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
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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
Pyranodioxins Acetophenones Phenoxy compounds Anisoles Aryl alkyl ketones Methoxybenzenes Benzoyl derivatives Alkyl aryl ethers Oxanes 1,3-dioxanes Monosaccharides Acetamides Secondary carboxylic acid amides Carboxylic acids Dialkyl ethers Monocarboxylic acids and derivatives Acetals Oxacyclic compounds Aldehydes Hydrocarbon derivatives Organic oxides Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Pyranodioxin - Acetophenone - Phenoxy compound - Anisole - Methoxybenzene - Benzoyl - Aryl alkyl ketone - Phenol ether - Alkyl aryl ether - Meta-dioxane - Monocyclic benzene moiety - Monosaccharide - Benzenoid - Oxane - Acetamide - Secondary carboxylic acid amide - Carboxamide group - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Ether - Dialkyl ether - Carboxylic acid - Carboxylic acid derivative - Acetal - Oxacycle - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Aldehyde - Organopnictogen compound - Organic nitrogen compound - Aromatic heteropolycyclic 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