Structure Information
Structure

Compound Identification

SMILES

[H]O[C@@]1([H])O[C@@]([H])(C([H])([H])[C@@]2(C([H])([H])[H])[C@]([H])(C([H])([H])[H])[C@]([H])(O[H])C(=O)[C@]3(C(=C([H])C([H])([H])C([H])([H])[C@@]23[H])C([H])([H])[H])C([H])([H])[H])[C@@]2(OC2([H])[H])[C@]1([H])O[H]

InChIKey

InChIKey=BHDYBYAEPPUJEJ-IORSCIEGSA-N

Formula

C20H30O6

Mass

366.454

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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

Aliphatic heteropolycyclic compounds

Substituents

Clerodane diterpenoid - Acyloin - Tetrahydrofuran - Cyclic alcohol - Alpha-hydroxy ketone - Secondary alcohol - Ketone - Oxacycle - Organoheterocyclic compound - Ether - Oxirane - Dialkyl ether - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Alcohol - Aliphatic 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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