Structure Information
Structure

Compound Identification

SMILES

CCCC1=C(OCC\C=C/C=C/[C@H]([C@@H](O)C2=CC=CC(C)=C2)C2=C(OC(O)=O)OC3=CC(=S)CC=C3C2=O)C=CC(C(C)=O)=C1O

InChIKey

InChIKey=IMLFIYHMEFXBOQ-ABHYKEANSA-N

Formula

C36H36O9S

Mass

644.74

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Taxonomic Classification

Taxonomy Tree

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

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Alkyl-phenylketone - Phenylpropane - Acetophenone - Phenoxy compound - Phenol ether - Aryl alkyl ketone - Benzoyl - Pyranone - 1-hydroxy-4-unsubstituted benzenoid - Phenol - Alkyl aryl ether - Toluene - Pyran - Benzenoid - Monocyclic benzene moiety - Carbonic acid monoester - Heteroaromatic compound - Vinylogous acid - Carbonic acid derivative - Thioketone - Secondary alcohol - Ether - Organoheterocyclic compound - Oxacycle - Organosulfur compound - Organic oxide - Aromatic alcohol - Alcohol - Thiocarbonyl group - Hydrocarbon derivative - 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

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