Structure Information
Structure

Compound Identification

SMILES

C[C@H](CC(O)=O)[C@]1(C)CC=C2C(C(O)=O)=C(C[C@]34CC[C@H](O3)C(C)(C)C4)C[C@@H](O)[C@@]12C

InChIKey

InChIKey=JVZMODMXLQSGPI-MKBZWPJDSA-N

Formula

C25H36O6

Mass

432.557

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Fatty Acyls

Subclass

Fatty acids and conjugates

Intermediate Tree Nodes

Not available

Direct Parent

Heterocyclic fatty acids

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Branched fatty acid - Heterocyclic fatty acid - Hydroxy fatty acid - Methyl-branched fatty acid - Dicarboxylic acid or derivatives - Tetrahydrofuran - Secondary alcohol - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Ether - Oxacycle - Organoheterocyclic compound - Organic oxygen compound - Organic oxide - Carbonyl group - Hydrocarbon derivative - Alcohol - Organooxygen compound - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as heterocyclic fatty acids. These are fatty acids containing a heterocyclic attached to the acyl chain.

External Descriptors

CHEBI:5461 : dicarboxylic acid
KEGG (C08765) : Triterpenoids (C30)

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