(2S)-1-[(2S)-2-(hexadecanoylamino)-3-oxidanyl-propanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: (2S)-1-[(2S)-2-(hexadecanoylamino)-3-oxidanyl-propanoyl]pyrrolidine-2-carboxylic acid Openeye Name: (2S)-1-[(2S)-2-(hexadecanoylamino)-3-hydroxy-propanoyl]pyrrolidine-2-carboxylic acid CAS Name: (2S)-1-[(2S)-3-hydroxy-1-oxo-2-(1-oxohexadecylamino)propyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2S)-1-[(2S)-2-(hexadecanoylamino)-3-hydroxypropanoyl]pyrrolidine-2-carboxylic acid Traditional Name: (2S)-1-[(2S)-3-hydroxy-2-palmitamido-propanoyl]proline Formula: C24H44N2O5 MolecularWeight: 440.61656

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)NC(CO)C(=O)N1CCCC1C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C24H44N2O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-22(28)25-20(19-27)23(29)26-18-15-16-21(26)24(30)31/h20-21,27H,2-19H2,1H3,(H,25,28)(H,30,31)/t20-,21-/m0/s1