PDB CCD ID: | SJ5 |
Number of entries in BioLiP: | 20 |
Chemical formula: | C6 H11 N O4 |
InChI: | InChI=1S/C6H11NO4/c8-4-2-7-1-3(5(4)9)6(10)11/h3-5,7-9H,1-2H2,(H,10,11)/t3-,4+,5+/m0/s1 |
InChIKey: | SSMLJUWXZFXWSF-VPENINKCSA-N |
SMILES: | Software | SMILES |
---|
OpenEye OEToolkits 2.0.6 | C1[C@@H]([C@H]([C@@H](CN1)O)O)C(=O)O | CACTVS 3.385 | O[C@@H]1CNC[C@@H]([C@H]1O)C(O)=O | ACDLabs 12.01 | C1NCC(C(O)=O)C(C1O)O | OpenEye OEToolkits 2.0.6 | C1C(C(C(CN1)O)O)C(=O)O | CACTVS 3.385 | O[CH]1CNC[CH]([CH]1O)C(O)=O |
|
Name: | (3S,4R,5R)-4,5-dihydroxypiperidine-3-carboxylic acid |
ChEMBL: | CHEMBL4589187 |