Structure Information
Structure

Compound Identification

SMILES

CC(C)CC(=O)O[C@@H]1\C=C/C(/CO)=C\C2OC(=O)C(C)C2(O)[C@H](OC(C)=O)C2[C@@]3(CO3)CC(OC(C)=O)C(OC(C)=O)[C@]12C

InChIKey

InChIKey=YQJSRCJPTWHXLB-QGRSNTLMSA-N

Formula

C31H42O13

Mass

622.664

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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

Diterpene lactones

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Diterpene lactone - Diterpenoid - Briarane diterpenoid - Pentacarboxylic acid or derivatives - Fatty acid ester - Fatty acyl - Gamma butyrolactone - Tertiary alcohol - Tetrahydrofuran - Lactone - Carboxylic acid ester - Organoheterocyclic compound - Oxacycle - Ether - Oxirane - Dialkyl ether - Carboxylic acid derivative - Primary alcohol - Carbonyl group - Organooxygen compound - Alcohol - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as diterpene lactones. These are diterpenoids containing a lactone moiety.

External Descriptors

Not available

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