trisodium (2S)-2-azanyl-4-[oxidanidyl-(4-oxidanidyl-1-oxidanyl-4-oxidanylidene-butan-2-yl)phosphoryl]butanoate

Systemtic Name: trisodium (2S)-2-azanyl-4-[oxidanidyl-(4-oxidanidyl-1-oxidanyl-4-oxidanylidene-butan-2-yl)phosphoryl]butanoate Openeye Name: trisodium (2S)-2-amino-4-[[1-(hydroxymethyl)-3-oxido-3-oxo-propyl]-oxido-phosphoryl]butanoate CAS Name: trisodium (2S)-2-amino-4-[(1-hydroxy-4-oxido-4-oxobutan-2-yl)-oxidophosphoryl]butanoate IUPAC Name: trisodium (2S)-2-amino-4-[(1-hydroxy-4-oxido-4-oxobutan-2-yl)-oxidophosphoryl]butanoate Traditional Name: trisodium (2S)-2-amino-4-[(3-keto-1-methylol-3-oxido-propyl)-oxido-phosphoryl]butyrate Formula: C8H13NNa3O7P MolecularWeight: 335.134391

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Descriptors Computed from Structure

Canonical SMILES:

C(CP(=O)(C(CC(=O)[O-])CO)[O-])C(C(=O)[O-])N.[Na+].[Na+].[Na+]

Isomeric SMILES

C(CP(=O)(C(CC(=O)[O-])CO)[O-])[C@@H](C(=O)[O-])N.[Na+].[Na+].[Na+]

InChI

InChI=1S/C8H16NO7P.3Na/c9-6(8(13)14)1-2-17(15,16)5(4-10)3-7(11)12;;;/h5-6,10H,1-4,9H2,(H,11,12)(H,13,14)(H,15,16);;;/q;3*+1/p-3/t5?,6-;;;/m0.../s1