| 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: AVR
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Formula: C13H17N3O1 Compound mass: 231.2929000000001 Compound with ALATIS labels (download): |
Download outputs in JSON format here.
Probabilities of the best carbohydrate fragment:
List of identified carbohydrate fragments:
C3H4N1O1
Fragment probability: 0.43
Fragment mass: 68.0969
Fragment main chain atoms: [3, 9, 13]
Fragment all atoms: [3, 24, 25, 26, 9, 32, 14, 13, 17]
Most similar ligands:
| Ligand Expo ID | PDB protein complex ID |
| AVR | 3IJG 3IJJ 4GRR |
| AVL | 4GRQ |
| 4HT | 1RUA 1RUM 1RU9 1RUL |
| 4LN | 4Z0K |
| 4PQ | 5KPY |