Structure Information
Structure

Compound Identification

SMILES

C[C@]1(CCC[C@@]2(C)[C@@H]3CC[C@]4(O)C[C@]3(C[C@@]4(O)CCl)CC[C@H]12)C=O

InChIKey

InChIKey=DTMIPKXLCMUODX-KOGWCRERSA-N

Formula

C20H31ClO3

Mass

354.92

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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

Kaurane diterpenoids

Alternative Parents

Molecular Framework

Aliphatic homopolycyclic compounds

Substituents

Kaurane diterpenoid - Cyclic alcohol - Tertiary alcohol - 1,2-diol - Chlorohydrin - Halohydrin - Organochloride - Organohalogen compound - Aldehyde - Organic oxygen compound - Alcohol - Carbonyl group - Alkyl halide - Alkyl chloride - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Aliphatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as kaurane diterpenoids. These are diterpene alkaloids with a structure that is based on the kaurane skeleton. Kaurane is a tetracyclic compound that arises by cyclisation of a pimarane precursor followed by rearrangement. It possesses a [3,2,1]-bicyclic ring system with C15-C16 bridge connected to C13, forming the five-membered ring D.

External Descriptors

Not available

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