Structure Information
Structure

Compound Identification

SMILES

OC(=O)CCCCCCCCCCN1C(=S)SC(=CC2=CC3=CC=CC=C3OC2C2=CC=CC=C2)C1=O

InChIKey

InChIKey=KKYLSJSKYTXMSA-UHFFFAOYSA-N

Formula

C30H33NO4S2

Mass

535.72

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Flavonoids

Subclass

Flav-3-enes

Intermediate Tree Nodes

Not available

Direct Parent

Flav-3-enes

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Flav-3-ene - Benzopyran - 1-benzopyran - Medium-chain fatty acid - Alkyl aryl ether - Heterocyclic fatty acid - Monocyclic benzene moiety - Thiazolidinethione - Fatty acyl - Benzenoid - Cyclic dithiocarbamic acid ester - Thiazolidine - Dithiocarbamic acid ester - Oxacycle - Monocarboxylic acid or derivatives - Ether - Carboxylic acid - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as flav-3-enes. These are flavonoids with a structure based on the 2-phenylchromene skeleton, with a double bond between the C3 and C4 carbon atoms of the chromene moiety.

External Descriptors

Not available

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