Structure Information
Structure

Compound Identification

SMILES

CC(=O)OC1CCC2(C)C(CC(=O)C3=COC=C3)C(=C)CCC2C1(C)C(O)=O

InChIKey

InChIKey=VZIHDWNPKBLDMB-UHFFFAOYSA-N

Formula

C22H28O6

Mass

388.46

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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 - Aryl alkyl ketone - Aryl ketone - Dicarboxylic acid or derivatives - Furan - Heteroaromatic compound - Carboxylic acid ester - Ketone - Carboxylic acid derivative - Carboxylic acid - Oxacycle - Organoheterocyclic compound - Organic oxide - Carbonyl group - Hydrocarbon derivative - Organooxygen compound - Organic oxygen compound - 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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