Structure Information
Structure

Compound Identification

SMILES

C[C@]12[C@@H]3[C@H](OC1=O)C=C1C[C@@](C)(CC[C@H]1[C@@]3(C)CCC2=O)C=C

InChIKey

InChIKey=MPHXYQVSOFGNEN-JGHPTVLTSA-N

Formula

C20H26O3

Mass

314.425

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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

Diterpenoids Naphthofurans Gamma butyrolactones Tetrahydrofurans Ketones Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Diterpene lactone - Diterpenoid - Pimarane diterpenoid - Naphthofuran - Gamma butyrolactone - Tetrahydrofuran - Lactone - Ketone - Carboxylic acid ester - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Oxacycle - Carboxylic acid derivative - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Carbonyl group - 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

CHEBI:49191 : diterpene lactone - pimarane diterpenoid
LIPIDMAPS (LMPR0104080002) : Pimarane diterpenoids
KEGG (C18015) : Pimarane diterpenoids

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