| 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: RCH
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Formula: C32H31N3O5S1 Compound mass: 569.6693999999981 Compound with ALATIS labels (download): |
Download outputs in JSON format here.
Probabilities of the best carbohydrate fragment:
List of identified carbohydrate fragments:
C5H9N1O1
Fragment probability: 0.50
Fragment mass: 96.1499
Fragment main chain atoms: [2, 31, 34, 30]
Fragment all atoms: [2, 45, 46, 47, 31, 4, 3, 51, 52, 53, 48, 49, 50, 34, 30, 37]
Most similar ligands:
| Ligand Expo ID | PDB protein complex ID |
| RCH | 5WR7 |
| 892 | 1T49 |
| BB3 | 1T48 |
| J6D | 5QJ0 |
| KYV | 6NRF |