2,3-bis(oxidanyl)propyl octadecanoate; (2S)-5-oxidanylidenepyrrolidine-2-carboxylic acid

Systemtic Name: 2,3-bis(oxidanyl)propyl octadecanoate; (2S)-5-oxidanylidenepyrrolidine-2-carboxylic acid Openeye Name: 2,3-dihydroxypropyl octadecanoate; (2S)-5-oxopyrrolidine-2-carboxylic acid CAS Name: octadecanoic acid 2,3-dihydroxypropyl ester; (2S)-5-oxo-2-pyrrolidinecarboxylic acid IUPAC Name: 2,3-dihydroxypropyl octadecanoate; (2S)-5-oxopyrrolidine-2-carboxylic acid Traditional Name: (2S)-5-ketoproline; stearic acid glyceryl ester Formula: C26H49NO7 MolecularWeight: 487.66976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OCC(CO)O.C1CC(=O)NC1C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OCC(CO)O.C1CC(=O)N[C@@H]1C(=O)O

InChI

InChI=1S/C21H42O4.C5H7NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22;7-4-2-1-3(6-4)5(8)9/h20,22-23H,2-19H2,1H3;3H,1-2H2,(H,6,7)(H,8,9)/t;3-/m.0/s1