Structure Information
Structure

Compound Identification

SMILES

CC(C)[C@@H]1CC[C@@H](C)C[C@H]1O[C@@H]1OC(=O)C[C@H]1C(SC1=CC=CC=C1)(SC1=CC=CC=C1)C1=CC=CC=C1

InChIKey

InChIKey=KLVPWKLNDSYCDU-IXXTWTCNSA-N

Formula

C33H38O3S2

Mass

546.78

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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 - Aromatic monoterpenoid - Monocyclic monoterpenoid - P-menthane monoterpenoid - Monoterpenoid - Aryl thioether - Thiophenol ether - Dithioketal - Alkylarylthioether - Monocyclic benzene moiety - Gamma butyrolactone - Benzenoid - Thioacetal - Oxolane - Lactone - Carboxylic acid ester - Sulfenyl compound - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Oxacycle - Acetal - Carboxylic acid derivative - Thioether - Organosulfur compound - Organooxygen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen 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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