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Frag

Formula
Molecular weight
Hydrogen bond donors
Hydrogen bond acceptors

Percent composition

Systematic name

Canonical SMILES

Isomeric SMILES

InChIKey

InChI

CAS Number

Chemspider ID

PubChem Compound ID

NIST source

FragView

Welcome to the educational platform for demonstrating metabolite fragmentation in MS/MS.

Know a SMILE you want to work with? Enter the SMILE to have a new tree created for it after loading is finished

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About

Fragview is an open-source tool that will assist in the fragmentation of metabolites. Users can enter the SMILE they wish to work with and fragment the molecule. Currently, Fragview only supports splitting a molecule into five fragments at once. Fragview is built off of Molview and uses some other libraries below to provide users with an easy way to fragment metabolites, export data about the fragment, including STL and MOL files, and quickly switch between molecules on the tree.

JavaScript libraries
- Ketcher: Chemical 2D data reader/writer
- JSmol: 3D render engine
- RDKitJS: Convert SMILES into 3D MOL data
- Treant.JS: Library for JS Tree structure
Other libraries
- MolView: Structure for entire application
- RDKit for Python: Convert SMILES into 2D MOL data

Fragview 1.1 + Terms of Use
Copyright © 2020 + License + GitHub

Periodic Table