Structure Information
Structure

Compound Identification

SMILES

O=C(CCC(C1=CC=CC=C1)C1=CC(=O)C=CC1=O)N1CCSCC1

InChIKey

InChIKey=JARZLVQEAJWDBX-UHFFFAOYSA-N

Formula

C20H21NO3S

Mass

355.45

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Neoflavonoids

Subclass

Dalbergiones

Intermediate Tree Nodes

Not available

Direct Parent

Dalbergiones

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Dalbergione skeleton - P-benzoquinone - Quinone - Monocyclic benzene moiety - 1,4-thiazinane - Benzenoid - Tertiary carboxylic acid amide - Cyclic ketone - Ketone - Carboxamide group - Organoheterocyclic compound - Azacycle - Thioether - Carboxylic acid derivative - Dialkylthioether - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as dalbergiones. These are quinone derivatives containing a dalbergione moiety, which consists of a 1-4 quinone conjugated to a phenyl group at ring carbon 2.

External Descriptors

Not available

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