Structure Information
Structure

Compound Identification

SMILES

CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)Oc1ccc2c(cc(=O)oc2c1)-c1ccccc1

InChIKey

InChIKey=CZIUJYUCDQBTSR-FQEVSTJZSA-N

Formula

C25H27NO6S

Mass

469.55

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Neoflavonoids

Subclass

Neoflavones

Intermediate Tree Nodes

Not available

Direct Parent

Neoflavones

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

4-phenylcoumarin - Methionine or derivatives - Alpha-amino acid ester - Coumarin - Alpha-amino acid or derivatives - Benzopyran - 1-benzopyran - Fatty acid ester - Pyranone - Fatty acyl - Monocyclic benzene moiety - Benzenoid - Pyran - Heteroaromatic compound - Carbamic acid ester - Carboxylic acid ester - Lactone - Carbonic acid derivative - Oxacycle - Organoheterocyclic compound - Dialkylthioether - Carboxylic acid derivative - Sulfenyl compound - Thioether - Monocarboxylic acid or derivatives - Organic nitrogen compound - Organic oxide - Organopnictogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as neoflavones. These are neoflavonoids with a structure based on the 4-phenylcoumarin skeleton.

External Descriptors

Not available

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