Structure Information
Structure

Compound Identification

SMILES

CC(C)CC(=O)O[C@@H]1C[C@H](OC(=O)CC(C)C)[C@@]2(C)[C@@H]([C@H](OC(C)=O)[C@@]3(O)C(C)C(=O)O[C@H]3\C=C(\COC(C)=O)/C=C/[C@@H]2OC(C)=O)[C@@]11CO1

InChIKey

InChIKey=LQYPQXKGPDRUES-IUXSMPSTSA-N

Formula

C36H50O14

Mass

706.782

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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

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