Structure Information
Structure

Compound Identification

SMILES

C[C@H]1[C@@H]2[C@@H]3[C@H](CCC(=C)[C@H]2C2=C(C[C@](C)(O)C2=O)C1=O)C3(C)C

InChIKey

InChIKey=AKYCTHTXCPVVOB-STPYIFJPSA-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

Diterpenoids

Intermediate Tree Nodes

Not available

Direct Parent

Jatropholane and crotopholane diterpenoids

Alternative Parents

Molecular Framework

Aliphatic homopolycyclic compounds

Substituents

Jatropholane or crotopholane diterpenoid - Cyclohexenone - Acyloin - Tertiary alcohol - Cyclic 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 jatropholane and crotopholane diterpenoids. These are diterpenoids with a structure based either on the jatropholane or the crotopholane skeleton. Jatropholanes arise by 5,13- and 6,10-cyclisation of a casbane precursor. Subsequent cleavage of the 2,15-cyclopropane bond affords crotofolane.

External Descriptors

Not available

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