disodium (2S,3S)-2-methylsulfanyl-3-oxidanyl-butanedioate

Systemtic Name: disodium (2S,3S)-2-methylsulfanyl-3-oxidanyl-butanedioate Openeye Name: disodium (2S,3S)-2-hydroxy-3-methylsulfanyl-butanedioate CAS Name: disodium (2S,3S)-2-hydroxy-3-(methylthio)butanedioate IUPAC Name: disodium (2S,3S)-2-hydroxy-3-methylsulfanylbutanedioate Traditional Name: disodium (2S,3S)-2-hydroxy-3-(methylthio)succinate Formula: C5H6Na2O5S MolecularWeight: 224.14268

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Descriptors Computed from Structure

Canonical SMILES:

CSC(C(C(=O)[O-])O)C(=O)[O-].[Na+].[Na+]

Isomeric SMILES

CS[C@@H]([C@H](C(=O)[O-])O)C(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C5H8O5S.2Na/c1-11-3(5(9)10)2(6)4(7)8;;/h2-3,6H,1H3,(H,7,8)(H,9,10);;/q;2*+1/p-2/t2-,3+;;/m1../s1