3XR
(2S,3R,4S,5S)-2-(acetylamino)-5-carboxy-3,4-dihydroxypiperidinium
Find entries where: 3XR
is present as a standalone ligand in 2 entries
Chemical Component Summary | |
|---|---|
| Name | (2S,3R,4S,5S)-2-(acetylamino)-5-carboxy-3,4-dihydroxypiperidinium |
| Identifiers | (3S,4S,5R,6S)-6-acetamido-4,5-bis(oxidanyl)piperidin-1-ium-3-carboxylic acid |
| Formula | C8 H15 N2 O5 |
| Molecular Weight | 219.215 |
| Type | NON-POLYMER |
| Isomeric SMILES | CC(=O)N[C@@H]1[C@H]([C@H]([C@H](C[NH2+]1)C(=O)O)O)O |
| InChI | InChI=1S/C8H14N2O5/c1-3(11)10-7-6(13)5(12)4(2-9-7)8(14)15/h4-7,9,12-13H,2H2,1H3,(H,10,11)(H,14,15)/p+1/t4-,5-,6-,7+/m0/s1 |
| InChIKey | DQTKLICLJUKNCG-ZTYPAOSTSA-O |
Chemical Details | |
|---|---|
| Formal Charge | 1 |
| Atom Count | 30 |
| Chiral Atom Count | 4 |
| Bond Count | 30 |
| Aromatic Bond Count | 0 |
Related Resource References
| Resource Name | Reference |
|---|---|
| PubChem | 137348189 |
