(2S)-4-[[(2R)-2-(3-hydroxyphenyl)-2-oxidanyl-ethyl]-methyl-amino]-2-oxidanyl-4-oxidanylidene-butanoate

Systemtic Name: (2S)-4-[[(2R)-2-(3-hydroxyphenyl)-2-oxidanyl-ethyl]-methyl-amino]-2-oxidanyl-4-oxidanylidene-butanoate Openeye Name: (2S)-2-hydroxy-4-[[(2R)-2-hydroxy-2-(3-hydroxyphenyl)ethyl]-methyl-amino]-4-oxo-butanoate CAS Name: (2S)-2-hydroxy-4-[[(2R)-2-hydroxy-2-(3-hydroxyphenyl)ethyl]-methylamino]-4-oxobutanoate IUPAC Name: (2S)-2-hydroxy-4-[[(2R)-2-hydroxy-2-(3-hydroxyphenyl)ethyl]-methylamino]-4-oxobutanoate Traditional Name: (2S)-2-hydroxy-4-[[(2R)-2-hydroxy-2-(3-hydroxyphenyl)ethyl]-methyl-amino]-4-keto-butyrate Formula: C13H16NO6- MolecularWeight: 282.26924

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(C1=CC(=CC=C1)O)O)C(=O)CC(C(=O)[O-])O

Isomeric SMILES

CN(C[C@@H](C1=CC(=CC=C1)O)O)C(=O)C[C@@H](C(=O)[O-])O

InChI

InChI=1S/C13H17NO6/c1-14(12(18)6-10(16)13(19)20)7-11(17)8-3-2-4-9(15)5-8/h2-5,10-11,15-17H,6-7H2,1H3,(H,19,20)/p-1/t10-,11-/m0/s1