Structure Information
Structure

Compound Identification

SMILES

CC(C)CC(=O)O[C@H]1C[C@@H](OC(C)=O)[C@]2(CO2)[C@@H]2[C@H](OC(C)=O)[C@]3(O)[C@@H](C)C(=O)O[C@H]3[C@@H](Cl)C(=C)CC[C@H](OC(C)=O)[C@@]12C

InChIKey

InChIKey=RUUYNOJIWKAXLY-BXMDPOMVSA-N

Formula

C31H43ClO12

Mass

643.12

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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 - Gamma butyrolactone - Fatty acyl - Tetrahydrofuran - Tertiary alcohol - Carboxylic acid ester - Lactone - Organoheterocyclic compound - Carboxylic acid derivative - Dialkyl ether - Oxacycle - Oxirane - Ether - Organochloride - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Alcohol - Organohalogen compound - Carbonyl group - Alkyl halide - Alkyl chloride - Organooxygen compound - 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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