Structure Information
Structure

Compound Identification

SMILES

COCC1C2CC(=O)[C@@H](C)CCC[C@@](C)(O)[C@@H](O)[C@@H]2OC1=O

InChIKey

InChIKey=RJDRJEKWGWPBOK-CEVMGBEXSA-N

Formula

C16H26O6

Mass

314.378

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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

Sesquiterpene lactones

Direct Parent

Germacranolides and derivatives

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Germacranolide - Germacrane sesquiterpenoid - Sesquiterpenoid - Gamma butyrolactone - Oxolane - Tertiary alcohol - 1,2-diol - Carboxylic acid ester - Ketone - Lactone - Secondary alcohol - Cyclic ketone - Ether - Dialkyl ether - Monocarboxylic acid or derivatives - Oxacycle - Carboxylic acid derivative - Organoheterocyclic compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Alcohol - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as germacranolides and derivatives. These are sesquiterpene lactones with a structure based on the germacranolide skeleton, characterized by a gamma lactone fused to a 1,7-dimethylcyclodec-1-ene moiety.

External Descriptors

Not available

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