Compound Identification
SMILES
COC1=CC(OC)=C(C=C1)C(=O)COC(=O)CCC(=O)C1=C(C)SC(C)=C1
InChIKey
InChIKey=UDDRVBRTCHRAIJ-UHFFFAOYSA-N
Formula
C20H22O6S
Mass
390.45
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
Dimethoxybenzenes Phenoxy compounds Gamma-keto acids and derivatives Benzoyl derivatives Aryl alkyl ketones Anisoles 2,3,5-trisubstituted thiophenes Fatty acid esters Alpha-acyloxy ketones Alkyl aryl ethers Heteroaromatic compounds Carboxylic acid esters Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alkyl-phenylketone - Dimethoxybenzene - M-dimethoxybenzene - Anisole - Benzoyl - Gamma-keto acid - Phenol ether - 2,3,5-trisubstituted thiophene - Aryl alkyl ketone - Phenoxy compound - Methoxybenzene - Alpha-acyloxy ketone - Fatty acid ester - Alkyl aryl ether - Fatty acyl - Benzenoid - Keto acid - Monocyclic benzene moiety - Heteroaromatic compound - Thiophene - Carboxylic acid ester - Carboxylic acid derivative - Organoheterocyclic compound - Ether - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organic oxide - 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