Structure Information
Structure

Compound Identification

SMILES

CC(C)C1=CC(=C(C=C1)C1CCCC1)C1=C(O)C(=S)C(=O)OC1C1=CC=C(OCC2=CN=CC=C2)C=C1

InChIKey

InChIKey=BRJXGBFHSWOVFQ-UHFFFAOYSA-N

Formula

C31H31NO4S

Mass

513.65

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Prenol lipids

Subclass

Terpene lactones

Intermediate Tree Nodes

Not available

Direct Parent

Terpene lactones

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Terpene lactone - Stilbene - P-cymene - Aromatic monoterpenoid - Monocyclic monoterpenoid - Monoterpenoid - Cumene - Phenylpropane - Phenoxy compound - Phenol ether - Alkyl aryl ether - Dihydropyranone - Benzenoid - Monocyclic benzene moiety - Pyridine - Pyran - Heteroaromatic compound - Thioketone - Carboxylic acid ester - Lactone - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Oxacycle - Enol - Ether - Monocarboxylic acid or derivatives - Thiocarbonyl group - Organopnictogen compound - Organic oxygen compound - Carbonyl group - Organosulfur compound - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as terpene lactones. These are prenol lipids containing a lactone ring.

External Descriptors

Not available

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