Structure Information
Structure

Compound Identification

SMILES

CC(C)C(=O)CC[C@@H](C)[C@@H]1CCC(C)=C2CC=C(C)[C@H]2[C@@H]1O

InChIKey

InChIKey=HXCYOOITWWXZRA-IXMYUCAJSA-N

Formula

C20H32O2

Mass

304.474

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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

Pachydictyane and cneorubin diterpenoids

Alternative Parents

Molecular Framework

Aliphatic homopolycyclic compounds

Substituents

Pachydictyane or cneorubin diterpenoid - Secondary alcohol - Ketone - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Alcohol - Aliphatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as pachydictyane and cneorubin diterpenoids. These are diterpenoids with a structure that is based either on the pachydictyane or the cneorubin skeleton. Pachydictyane is a bicyclic compound consisting of a guaiane skeleton that carries a prenyl group attached to the C12 carbon atom. Cneorubin is a tricyclic compound consisting of a cycloprop[e]azulene where the cyclopropane carries a methyl group and a 4-methylpentyl group.

External Descriptors

Not available

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