PDB CCD ID: | DGJ |
Number of entries in BioLiP: | 34 |
Chemical formula: | C6 H13 N O4 |
InChI: | InChI=1S/C6H13NO4/c8-2-3-5(10)6(11)4(9)1-7-3/h3-11H,1-2H2/t3-,4+,5+,6-/m1/s1 |
InChIKey: | LXBIFEVIBLOUGU-DPYQTVNSSA-N |
SMILES: | Software | SMILES |
---|
ACDLabs 12.01 | OC1C(NCC(O)C1O)CO | OpenEye OEToolkits 1.7.2 | C1C(C(C(C(N1)CO)O)O)O | OpenEye OEToolkits 1.7.2 | C1[C@@H]([C@H]([C@H]([C@H](N1)CO)O)O)O | CACTVS 3.370 | OC[CH]1NC[CH](O)[CH](O)[CH]1O | CACTVS 3.370 | OC[C@H]1NC[C@H](O)[C@@H](O)[C@H]1O |
|
Name: | (2R,3S,4R,5S)-2-(hydroxymethyl)piperidine-3,4,5-triol; 1-deoxygalactonojirimycin |
ChEMBL: | CHEMBL110458 |
DrugBank: | DB05018 |
ZINC: | ZINC000001636704 |