(2R,4S)-1-(2-methylbutanoyl)-4-sulfooxy-pyrrolidine-2-carboxylic acid

Systemtic Name: (2R,4S)-1-(2-methylbutanoyl)-4-sulfooxy-pyrrolidine-2-carboxylic acid Openeye Name: (2R,4S)-1-(2-methylbutanoyl)-4-sulfooxy-pyrrolidine-2-carboxylic acid CAS Name: (2R,4S)-1-(2-methyl-1-oxobutyl)-4-sulfooxy-2-pyrrolidinecarboxylic acid IUPAC Name: (2R,4S)-1-(2-methylbutanoyl)-4-sulfooxypyrrolidine-2-carboxylic acid Traditional Name: (2R,4S)-1-(2-methylbutanoyl)-4-sulfoxy-proline Formula: C10H17NO7S MolecularWeight: 295.30948

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)N1CC(CC1C(=O)O)OS(=O)(=O)O

Isomeric SMILES

CCC(C)C(=O)N1C[C@H](C[C@@H]1C(=O)O)OS(=O)(=O)O

InChI

InChI=1S/C10H17NO7S/c1-3-6(2)9(12)11-5-7(18-19(15,16)17)4-8(11)10(13)14/h6-8H,3-5H2,1-2H3,(H,13,14)(H,15,16,17)/t6?,7-,8+/m0/s1