(2S,4S,5S,6R)-5-acetamido-6-(hydroxymethyl)-4-oxidanyl-piperidine-2-carboxylic acid

Systemtic Name: (2S,4S,5S,6R)-5-acetamido-6-(hydroxymethyl)-4-oxidanyl-piperidine-2-carboxylic acid Openeye Name: (2S,4S,5S,6R)-5-acetamido-4-hydroxy-6-(hydroxymethyl)piperidine-2-carboxylic acid CAS Name: (2S,4S,5S,6R)-5-acetamido-4-hydroxy-6-(hydroxymethyl)-2-piperidinecarboxylic acid IUPAC Name: (2S,4S,5S,6R)-5-acetamido-4-hydroxy-6-(hydroxymethyl)piperidine-2-carboxylic acid Traditional Name: (2S,4S,5S,6R)-5-acetamido-4-hydroxy-6-methylol-pipecolinic acid Formula: C9H16N2O5 MolecularWeight: 232.23374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C(CC(NC1CO)C(=O)O)O

Isomeric SMILES

CC(=O)N[C@@H]1[C@H](C[C@H](N[C@H]1CO)C(=O)O)O

InChI

InChI=1S/C9H16N2O5/c1-4(13)10-8-6(3-12)11-5(9(15)16)2-7(8)14/h5-8,11-12,14H,2-3H2,1H3,(H,10,13)(H,15,16)/t5-,6-,7-,8-/m0/s1