| 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: J0T
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Formula: C25F2H26N6O5S1 Compound mass: 560.5718999999985 Compound with ALATIS labels (download): |
Download outputs in JSON format here.
Probabilities of the best carbohydrate fragment:
List of identified carbohydrate fragments:
C6H10N1O4
Fragment probability: 1.00
Fragment mass: 160.14750000000004
Fragment main chain atoms: [24, 22, 23, 21, 38, 25, 60, 37, 65, 36, 59, 64]
Fragment all atoms: [24, 22, 58, 33, 23, 21, 57, 12, 52, 53, 34, 62, 38, 25, 61, 60, 37, 65, 36, 59, 64]
Most similar ligands:
| Ligand Expo ID | PDB protein complex ID |
| J0T | 6QGF 6RHL |
| J1E | 6RHM 6QGE |
| TD2 | 5H9P 5H9Q 5E89 4Y24 |
| TGZ | 5H9R 5H9S |
| 5KS | 5E8A |