| 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: ENL
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Formula: C8H10O5 Compound mass: 186.16160000000008 Compound with ALATIS labels (download): |
Download outputs in JSON format here.
Probabilities of the best carbohydrate fragment:
List of identified carbohydrate fragments:
C8H10O5
Fragment probability: 1.00
Fragment mass: 202.16100000000006
Fragment main chain atoms: [2, 4, 6, 5, 3, 1]
Fragment all atoms: [2, 16, 17, 4, 19, 13, 6, 21, 8, 11, 12, 23, 5, 20, 7, 10, 9, 22, 3, 18, 1, 14, 15]
Most similar ligands:
| Ligand Expo ID | PDB protein complex ID |
| 4TE | 4ZX2 |
| ENL | 3H61 3H69 3H64 |
| NHC | 3H67 3H63 3H62 3H68 |
| 4TF | 4ZVZ |
| KD5 | 4E52 |