| Cheminformatics Tool for Probabilistic Identification of Carbohydrates (CTPIC) v 1.1 (Spring 2020) |
|||||||||||||||
|
Home Process a structure file Publication files: |
Submission ID: GZQ
|
|
Formula: C9Cl2H9N1O1 Compound mass: 218.07950000000008 Compound with ALATIS labels (download): |
Download outputs in JSON format here.
Probabilities of the best carbohydrate fragment:
List of identified carbohydrate fragments:
C3H6N1O1
Fragment probability: 0.57
Fragment mass: 98.10300000000001
Fragment main chain atoms: [1, 6, 12, 2]
Fragment all atoms: [1, 14, 15, 16, 6, 13, 12, 2, 17, 18, 19]
Most similar ligands:
| Ligand Expo ID | PDB protein complex ID |
| GZQ | 6I0Z |
| CXH | 6F8B |
| ELN | 6G30 |
| 1T4 | 4KKY |
| NSA |