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Untargeted Metabolomics

Untargeted metabolomics enables the unbiased detection of dynamic changes in most small molecule metabolites within an organism in response to external stimuli. By leveraging Liquid Chromatography-Mass Spectrometry (LC-MS), researchers can gain comprehensive insights into biological systems influenced by environmental, genetic ortherapeutic variations.

At Novogene, our comprehensive untargeted metabolomics services offer the latest state-of-the-art LC-MS technologies together with cutting-edge bioinformatics analyses to deliver high-quality metabolomic data to support your research.

Applications:

Untargeted metabolomics plays a vital role in agricultural, clinical, and medical research by offering insights into plant and soil metabolite profiles, stress responses, and environmental interactions, while also facilitating the in-depth study of metabolic changes related to diseases, drug responses, and personalized medicine.

  • Stress Resistance Research
  • Crop Improvement & Breeding
  • Plant Growth, Soil Health & Microbial Interactions
  • Food Science Research
  • Biomarker Screening
  • Pathological Mechanisms

Advantages and Features of Novogene's Untargeted Metabolomics Services

  • Ultra-high Resolution and Sensitivity: Powered by the TripleTOF 6600+ mass spectrometry platform, Novogene delivers exceptional data quality for precise and reliable results.
  • High Quality Database::
    • Access to an extensive catalog of over 280,000 metabolites, complemented by a repository of 30,000+ purified chemical standards spanning diverse metabolite classes. This rich collection forms the cornerstone for precise metabolite identification and analysis.
  • Rigorous Quality Control: 10 QC indicators for monitoring all aspects of experimentation from sample preparation to data collection.
  • Comprehensive Metabolite Information:
    1) In-house standard database;
    2) Integrated public database;
    3) AI database;

Sample Requirements for Animal Tissues and Fluids Metabolomics Samples:

Sample Type Sample Recommended Sample Minimum Sample Biological Replicate
Liquid Plasma, Serum, Hemolymph, Milk, Egg White 100μL 20μL human≥30, animal≥8, Plant≥3
Cerebrospinal Fluid, Tear Fluid, Interstitial Fluid, Uterine Fluid, Pancreatic Fluid and Bile, Pleural Effusion, Follicular Fluid, Culture Medium 100μL 20μL
Seminal Plasma, Amniotic Fluid, Prostate Fluid, Rumen Fluid, Respiratory Condensate, Gastric Lavage Fluid, Alveolar Lavage Fluid, Urine, Sweat, Saliva, Sputum 500μL 100μL
Tissue Animal Tissue, Placenta, Thrombus, Fish Skin, Nematode 100mg 20mg
Insect Whole Body, Insect Wings, Pupae 500mg 20mg
Zebrafish Organs, Insect Organs 20mg 10mg
Stem, Bud, Node, Leaf, Root, Flower, Fruit, Healing Tissue, Animal Tissue 300mg 200mg
Cell Adherent Cells 1*10^6 5*10^5

Notes:
1) Not applicable for GC-MS.
2) For extracted metabolites, we advise the recommended quantity for the extraction process.
3) Appropriate for Untargeted Metabolomics, TM Widely-Targeted Metabolomics, Quantitative Lipidomics, and Energy Metabolism studies.

Sample Requirements for Plant Tissues and Fluids Metabolomics Samples:

Sample Type Sample Recommended Sample Minimum Sample Biological replicate
Tissue Fresh Tissue Sample: Root、Stem、Leaf、Flower、Fruit 600mg 300mg human≥30, animal≥8, Plant≥3
Dry Sample 50mg 30mg
Liquid Root secretion 10ml 3ml
Wine,Fermented Broth 5ml 3ml
Tissue fluid、Extracting solution 500μl 200μl
Jjuice 5ml 3ml
Oil、Essential oil 500μl 200μl
Honey 500μl 200μl
Special Tissue Trichome 50mg 15mg

Notes:
1) Not applicable for GC-MS.
2) For extracted metabolites, please advise on the recommended quantity for the extraction process.
3) Suitable for Widely-Targeted Metabolomics for Plants and Flavonoids Metabolomics.
4) Recommended sampling approach:
– Collect samples from 3 or more individuals for each biological replicate.
– Ensure a minimum of 3 biological replicates per sample group.
– Example: Combine leaves from 3 individual plants as one replicate; repeat for 2 more replicates (involving 6 additional individual plants) to achieve 3 biological replicates for one experimental group (e.g., Control).
– Repeat the process with 9 individual plants for the second experimental group (e.g., Treatment).

List of Detectable Metabolites

Database Type Metabolites MS2 Spectra Notes
Integrated Public Database 150,000+ 2,000,000+ Aggregates data from KEGG, HMDB, METLIN, MassBank, and LipidSearch
AI Database 130,000+ 720,000+ AI-curated library to expand identification coverage and confidence
In-House Database 3,000+ 20,000+ Custom-developed database for validated, high-confidence metabolite annotation

Project Workflow

Metabolomics research experimental procedures encompass sample collection and pre-processing, metabolite extraction, LC-MS data acquisition, metabolite annotation and identification through database searching, and bioinformatic analysis. These steps enable researchers to gain holistic insights into the metabolic state of a system.

At Novogene, we uphold the highest standards of precision and quality control at every step of the experimental process, ensuring consistent, reliable and high-quality data for your research.

Metabolite Classification Pie Chart

Visualization of the proportion of different metabolite categories based on their respective numbers.


PCA analysis of total samples

Convert a group of variables that may have correlation into a group of linear uncorrelated variables through orthogonal transformation


PLS-DA plot

Uses partial least squares regression to establish the relationship model between the relative quantitative value of metabolites and the sample category to realize the prediction of the sample category.


Volcano plot of differential metabolites

Volcano plot of differential metabolites


Lollipop chart of different metabolites

Show the up and down-regulation of the metabolites and the substances with large difference multiple changes.


Box plot of differential metabolite

Display the measurement statistics of the central trend and the measurement statistics of the dispersion.


Differential metabolite violin map

The distribution pattern of the same metabolite across different groups.


K-Means analysis of differential metabolites

The variation trend of metabolites across different groups.


Correlation analysis of different metabolites

The consistency of variation trends between pairs of metabolites, where red indicates a positive correlation and blue indicates a negative correlation.


Chord diagram of differential metabolites

Reflects the correlation and association between pairs of differential metabolites.


Z-score analysis

The relative abundance levels across different groups.


Cluster analysis of differential metabolites

Metabolites with similar or identical metabolic patterns are clustered together to infer their functions.


KEGG enrichment bubble diagram

The hypergeometric test algorithm is used to analyze the relevant metabolic pathways associated with differential metabolites between two groups.


KEGG enrichment pathway diagram


GSEA analysis


ROC curve Analysis of differential metabolite

Use the Area Under the Curve (AUC) to evaluate the sensitivity and specificity of metabolite detection.