# Structural Modification of Selected Essential Oil Components for Potential Anticancer Applications: A Review

**Authors:** Vuyolwethu Khwaza, Vuyani Maqanda

PMC · DOI: 10.3390/ph19030427 · Pharmaceuticals · 2026-03-05

## TL;DR

This paper reviews how modifying the structure of essential oil compounds can improve their anticancer properties, though more research is needed for clinical use.

## Contribution

The paper provides a critical review of structural modification strategies for essential oil components to enhance their anticancer potential.

## Key findings

- Structural modifications like esterification and halogenation can significantly boost anticancer potency.
- Pharmacophore hybridization and heterocycle incorporation are promising modification approaches.
- Current studies lack standardization, limiting comparisons and translational potential.

## Abstract

Monoterpenes (thymol, carvacrol, menthol) and phenylpropanoids (eugenol and cinnamaldehyde) and their related derivatives are naturally occurring bioactive compounds found in essential oils (EOs) and have attracted considerable interest as anticancer agents; however, their direct therapeutic use in cancer treatment is often limited by factors such as low bioavailability, moderate potency, and lack of target specificity. Recent studies have demonstrated that rational structural modification of these EO scaffolds can substantially enhance their anticancer potential. This review critically evaluates the different structural modification strategies applied to EO components, including pharmacophore hybridization, heterocycle incorporation (e.g., triazoles, oxadiazoles, chalcones), esterification, halogenation, metal complexation, and nanoparticle conjugation. The review compares these approaches across the selected EO components, highlighting their impact on anticancer potency, and mechanistic relevance. However, the current evidence base is heterogeneous, with considerable variability in experimental conditions, selectivity assessments, and reliance on in vitro or in silico findings, which limits direct cross-study comparisons and translational interpretation. Overall, structural modification of EO components represents a promising strategy for generating novel anticancer lead compounds, but future progress will depend on standardized biological evaluation, rigorous in vivo validation, and comprehensive pharmacokinetic and toxicity profiling to realistically define their clinical potential.

## Linked entities

- **Chemicals:** thymol (PubChem CID 6989), carvacrol (PubChem CID 10364), menthol (PubChem CID 1254), eugenol (PubChem CID 3314), cinnamaldehyde (PubChem CID 637511), triazoles (PubChem CID 67516), oxadiazoles (PubChem CID 10197612)
- **Diseases:** cancer (MONDO:0004992)

## Full-text entities

- **Diseases:** cancer (MESH:D009369), toxicity (MESH:D064420)
- **Chemicals:** EO (MESH:D009822), eugenol (MESH:D005054), metal (MESH:D008670), menthol (MESH:D008610), triazoles (MESH:D014230), thymol (MESH:D013943), Oil (MESH:D009821), carvacrol (MESH:C073316), Monoterpenes (MESH:D039821), chalcones (MESH:D047188), cinnamaldehyde (MESH:C012843), oxadiazoles (MESH:D010069), phenylpropanoids (-)

## Full text

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## Figures

7 figures with captions in the complete paper: https://tomesphere.com/paper/PMC13028705/full.md

## References

108 references — full list in the complete paper: https://tomesphere.com/paper/PMC13028705/full.md

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Source: https://tomesphere.com/paper/PMC13028705