| 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: J1H
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Formula: C44Cl1H48N6O7S2 Compound mass: 872.4689999999975 Compound with ALATIS labels (download): |
Download outputs in JSON format here.
Probabilities of the best carbohydrate fragment:
List of identified carbohydrate fragments:
C3H6N1O2
Fragment probability: 0.71
Fragment mass: 131.15259999999998
Fragment main chain atoms: [43, 30, 51, 2]
Fragment all atoms: [43, 52, 53, 108, 30, 101, 102, 51, 2, 64, 65, 66]
Most similar ligands:
| Ligand Expo ID | PDB protein complex ID |
| J1H | 6QGG |
| N3C | 2YXJ |
| X0J | 3INQ |
| LIW | 2O2N |
| 1E9 | 4IEH |