1-[6-methyl-5-oxidanyl-2-(sulfanylmethyl)heptanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[6-methyl-5-oxidanyl-2-(sulfanylmethyl)heptanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[5-hydroxy-6-methyl-2-(sulfanylmethyl)heptanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[5-hydroxy-2-(mercaptomethyl)-6-methyl-1-oxoheptyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[5-hydroxy-6-methyl-2-(sulfanylmethyl)heptanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[5-hydroxy-2-(mercaptomethyl)-6-methyl-heptanoyl]proline Formula: C14H25NO4S MolecularWeight: 303.4176

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCC(CS)C(=O)N1CCCC1C(=O)O)O

Isomeric SMILES

CC(C)C(CCC(CS)C(=O)N1CCCC1C(=O)O)O

InChI

InChI=1S/C14H25NO4S/c1-9(2)12(16)6-5-10(8-20)13(17)15-7-3-4-11(15)14(18)19/h9-12,16,20H,3-8H2,1-2H3,(H,18,19)