2-[[2-(hydroxymethyl)-3-sulfanyl-propanoyl]amino]pentanedioic acid

Systemtic Name: 2-[[2-(hydroxymethyl)-3-sulfanyl-propanoyl]amino]pentanedioic acid Openeye Name: 2-[[2-(hydroxymethyl)-3-sulfanyl-propanoyl]amino]pentanedioic acid CAS Name: 2-[[2-(hydroxymethyl)-3-mercapto-1-oxopropyl]amino]pentanedioic acid IUPAC Name: 2-[[2-(hydroxymethyl)-3-sulfanylpropanoyl]amino]pentanedioic acid Traditional Name: 2-[[3-hydroxy-2-(mercaptomethyl)propanoyl]amino]glutaric acid Formula: C9H15NO6S MolecularWeight: 265.2835

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Descriptors Computed from Structure

Canonical SMILES:

C(CC(=O)O)C(C(=O)O)NC(=O)C(CO)CS

Isomeric SMILES

C(CC(=O)O)C(C(=O)O)NC(=O)C(CO)CS

InChI

InChI=1S/C9H15NO6S/c11-3-5(4-17)8(14)10-6(9(15)16)1-2-7(12)13/h5-6,11,17H,1-4H2,(H,10,14)(H,12,13)(H,15,16)