Structure Information
Structure

Compound Identification

SMILES

C[C@@H]1CCC2[C@H](CC(=O)C=C2C)[C@@]11C[C@@H](OC1=O)C1=COC=C1

InChIKey

InChIKey=PHTWCRQCDPNVLQ-FVHUFZOMSA-N

Formula

C19H22O4

Mass

314.381

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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

Colensane and clerodane diterpenoids Cyclohexenones Gamma butyrolactones Tetrahydrofurans Heteroaromatic compounds Furans Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Clerodane diterpenoid - Diterpenoid - Diterpene lactone - Cyclohexenone - Gamma butyrolactone - Heteroaromatic compound - Tetrahydrofuran - Furan - Cyclic ketone - Lactone - Ketone - Carboxylic acid ester - Oxacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aromatic 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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