Compound Identification
SMILES
COC1=CC(NC(=O)CCC(=O)CC(=O)C2=CC(OC)=C(O)C=C2)=C(OC)C=C1
InChIKey
InChIKey=MSSNBOIWFSCKBV-UHFFFAOYSA-N
Formula
C21H23NO7
Mass
401.415
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Phenols
-
Subclass
Methoxyphenols
- Level 5 Paradols
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Subclass
Methoxyphenols
-
Class
Phenols
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Phenols
Subclass
Methoxyphenols
Intermediate Tree Nodes
Not available
Direct Parent
Paradols
Alternative Parents
Alkyl-phenylketones Butyrophenones Dimethoxybenzenes Anilides Methoxyanilines Phenoxy compounds Benzoyl derivatives Aryl alkyl ketones Anisoles N-arylamides Beta-diketones 1-hydroxy-2-unsubstituted benzenoids Alkyl aryl ethers Fatty amides Secondary carboxylic acid amides Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Paradol - Alkyl-phenylketone - Butyrophenone - Dimethoxybenzene - P-dimethoxybenzene - Anilide - Methoxyaniline - Phenylketone - Methoxybenzene - Anisole - Phenol ether - Phenoxy compound - Aryl alkyl ketone - Benzoyl - Aryl ketone - N-arylamide - 1-hydroxy-2-unsubstituted benzenoid - 1,3-diketone - Alkyl aryl ether - Monocyclic benzene moiety - Fatty amide - Fatty acyl - 1,3-dicarbonyl compound - Ketone - Carboxamide group - Secondary carboxylic acid amide - Ether - Carboxylic acid derivative - Organonitrogen compound - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organic nitrogen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as paradols. These are compounds containing a paradol moiety, which is consists of a benzene ring with a decan-3-one moiety, a methoxyl group, and a hydroxyl group at positions 1,3, and 4 respectively.
External Descriptors
Not available