(2S)-1-[(2R)-2-(octadecanoylamino)-3-oxidanyl-propanoyl]pyrrolidine-2-carboxamide

Systemtic Name: (2S)-1-[(2R)-2-(octadecanoylamino)-3-oxidanyl-propanoyl]pyrrolidine-2-carboxamide Openeye Name: (2S)-1-[(2R)-3-hydroxy-2-(octadecanoylamino)propanoyl]pyrrolidine-2-carboxamide CAS Name: (2S)-1-[(2R)-3-hydroxy-1-oxo-2-(1-oxooctadecylamino)propyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-1-[(2R)-3-hydroxy-2-(octadecanoylamino)propanoyl]pyrrolidine-2-carboxamide Traditional Name: (2S)-1-[(2R)-3-hydroxy-2-stearamido-propanoyl]pyrrolidine-2-carboxamide Formula: C26H49N3O4 MolecularWeight: 467.68496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)NC(CO)C(=O)N1CCCC1C(=O)N

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)N[C@H](CO)C(=O)N1CCC[C@H]1C(=O)N

InChI

InChI=1S/C26H49N3O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-24(31)28-22(21-30)26(33)29-20-17-18-23(29)25(27)32/h22-23,30H,2-21H2,1H3,(H2,27,32)(H,28,31)/t22-,23+/m1/s1