| 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: PHC
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Formula: C10H13N1O1 Compound mass: 163.2158000000001 Compound with ALATIS labels (download): |
Download outputs in JSON format here.
Probabilities of the best carbohydrate fragment:
List of identified carbohydrate fragments:
C2H4N1O1
Fragment probability: 0.60
Fragment mass: 85.0844
Fragment main chain atoms: [8, 11, 2]
Fragment all atoms: [8, 24, 12, 11, 2, 16, 17, 18]
Most similar ligands:
| Ligand Expo ID | PDB protein complex ID |
| PHC | |
| BNF | 1U3U 5VL0 |
| BAS | |
| JPY | 3X2S |
| PMQ |