| Cheminformatics Tool for Probabilistic Identification of Carbohydrates (CTPIC) v 1.1 (Spring 2020) |
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Home Process a structure file Publication files: |
Submission ID: JTF
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Formula: C14H19N3O1 Compound mass: 245.3194000000001 Compound with ALATIS labels (download): |
Download outputs in JSON format here.
Probabilities of the best carbohydrate fragment:
List of identified carbohydrate fragments:
C2H6N1
Fragment probability: 0.20
Fragment mass: 72.10870000000001
Fragment main chain atoms: [2, 17, 3]
Fragment all atoms: [2, 22, 23, 24, 17, 3, 25, 26, 27]
Most similar ligands:
| Ligand Expo ID | PDB protein complex ID |
| JTF | 5A5P |
| J5I | 5A5O |
| P34 | 3GEY 4BJB 4TJW 1XK9 4KXJ 2Q6M 1ZM9 3CE0 3UH2 4UXB 6EDG 5EWK 4FK7 |
| G1O | 4UVT |
| KUF | 5AM2 |