Integrating Untargeted GC-MS Metabolomics, GNPS Molecular Networking, and Machine Learning for Sugarcane Byproduct Valorization

-butyl methyl ether (TBME) and hexane enabled selective enrichment of sterols and long-chain alcohols. By integrating molecular data with statistical modeling and yield analysis, this study presents a data-driven framework for optimizing biorefinery processes. These findings offer critical insights into aligning solvent systems with specific biomass types to enhance the efficiency, economic value, and environmental sustainability of sugarcane residue valorization.

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Publication Details

Journal
ACS Omega
Published
2026-04-06
DOI
https://doi.org/10.1021/acsomega.6c00047
Primary Topic
Sugarcane Cultivation and Processing
Type
article
Field-Weighted Citation Impact
0.00

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article

Integrating Untargeted GC-MS Metabolomics, GNPS Molecular Networking, and Machine Learning for Sugarcane Byproduct Valorization

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Integrating Untargeted GC-MS Metabolomics, GNPS Molecular Networking, and Machine Learning for Sugarcane Byproduct Valorization

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article en

Abstract

-butyl methyl ether (TBME) and hexane enabled selective enrichment of sterols and long-chain alcohols. By integrating molecular data with statistical modeling and yield analysis, this study presents a data-driven framework for optimizing biorefinery processes. These findings offer critical insights into aligning solvent systems with specific biomass types to enhance the efficiency, economic value, and environmental sustainability of sugarcane residue valorization.

ACS OmegaVol. 11(15)
National Science and Technology Development Agency (TH), Joint Graduate School of Energy and Environment (TH), Sugarcane Research Center (Brazil) (BR), Mitsui Sugar (Japan) (JP), Institut de Recherche et d’Innovation (FR), King Mongkut's University of Technology Thonburi (TH), National Center for Genetic Engineering and Biotechnology (TH)
National Research Council of Thailand
Zero hunger
Openalex Percentile: Top 31%
Sugarcane Cultivation and Processing
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