Structure Information
Structure

Compound Identification

SMILES

C\C(=C/C=C/[C@@]1(C)OC(=O)[C@@]23CC[C@H]1[C@@]2(O)CCC(C)=CC3)C([O-])=O

InChIKey

InChIKey=MQOMHFMKUJFDBH-UNZAVUEUSA-M

Formula

C20H25O5

Mass

345.416

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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

Prenyldaucane diterpenoid - Diterpenoid - Diterpene lactone - Secoiridoid-skeleton - Caprolactone - Methyl-branched fatty acid - Oxepane - Delta_valerolactone - Hydroxy fatty acid - Heterocyclic fatty acid - Fatty acid ester - Delta valerolactone - Branched fatty acid - Fatty acyl - Unsaturated fatty acid - Oxane - Dicarboxylic acid or derivatives - Tertiary alcohol - Cyclic alcohol - Lactone - Carboxylic acid ester - Oxacycle - Organoheterocyclic compound - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Alcohol - Organic anion - 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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