| 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: ONV
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Formula: C22Cl1H20N3O7 Compound mass: 473.86229999999995 Compound with ALATIS labels (download): |
Download outputs in JSON format here.
Probabilities of the best carbohydrate fragment:
List of identified carbohydrate fragments:
C6H6N1O2
Fragment probability: 0.38
Fragment mass: 110.11370000000001
Fragment main chain atoms: [9, 18, 26, 20]
Fragment all atoms: [9, 43, 44, 27, 52, 18, 48, 11, 2, 1, 35, 34, 26, 20, 28]
Most similar ligands:
| Ligand Expo ID | PDB protein complex ID |
| ONV | 6PLF |
| ONS | 6PLG |
| CP4 | 1EM6 |
| K5K | 6RJ6 |
| A46 | 2ZB2 |