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

Systemtic Name: 2-[[2-(hydroxymethyl)-3-sulfanyl-propanoyl]amino]-3-oxidanyl-propanoic acid Openeye Name: 3-hydroxy-2-[[2-(hydroxymethyl)-3-sulfanyl-propanoyl]amino]propanoic acid CAS Name: 3-hydroxy-2-[[2-(hydroxymethyl)-3-mercapto-1-oxopropyl]amino]propanoic acid IUPAC Name: 3-hydroxy-2-[[2-(hydroxymethyl)-3-sulfanylpropanoyl]amino]propanoic acid Traditional Name: 3-hydroxy-2-[[3-hydroxy-2-(mercaptomethyl)propanoyl]amino]propionic acid Formula: C7H13NO5S MolecularWeight: 223.24682

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H13NO5S/c9-1-4(3-14)6(11)8-5(2-10)7(12)13/h4-5,9-10,14H,1-3H2,(H,8,11)(H,12,13)