Structure Information
Structure

Compound Identification

SMILES

CC1=CCC[C@@H]2[C@](C)(CCC3=COC=C3)[C@H](COC(=O)CCC(O)=O)CC[C@]12C

InChIKey

InChIKey=VMJXBULAZAIARU-UWXQAFAOSA-N

Formula

C24H34O5

Mass

402.531

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Prenol lipids

Subclass

Diterpenoids

Intermediate Tree Nodes

Not available

Direct Parent

Colensane and clerodane diterpenoids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Clerodane diterpenoid - Fatty acid ester - Fatty acyl - Dicarboxylic acid or derivatives - Heteroaromatic compound - Furan - Carboxylic acid ester - Oxacycle - Organoheterocyclic compound - Carboxylic acid - 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 colensane and clerodane diterpenoids. These are diterpenoids with a structure based on the clerodane or the colensane skeleton. Clerodanes arise from labdanes by two methyl migrations.

External Descriptors

Not available

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