Structure Information
Structure

Compound Identification

SMILES

CC[C@@]1(C)CCC2[C@@](C)(CC[C@@]3(C)[C@@H]4CC(C)(C)CC[C@@]4(CC[C@]23C)C(O)=O)[C@@H]1CCC(O)=O

InChIKey

InChIKey=FTXPTSPQRPOGGC-KSAYVFEYSA-N

Formula

C30H50O4

Mass

474.726

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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 homopolycyclic compounds

Substituents

Clerodane diterpenoid - 3-carboxy steroid - Steroid acid - Steroid - Carbocyclic fatty acid - Fatty acyl - Dicarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic homopolycyclic 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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