(2S)-2-azaniumyl-4-[[(2S)-2-methyl-3-oxidanidyl-3-oxidanylidene-propyl]-oxidanyl-phosphoryl]butanoate

Systemtic Name: (2S)-2-azaniumyl-4-[[(2S)-2-methyl-3-oxidanidyl-3-oxidanylidene-propyl]-oxidanyl-phosphoryl]butanoate Openeye Name: (2S)-2-azaniumyl-4-[hydroxy-[(2S)-2-methyl-3-oxido-3-oxo-propyl]phosphoryl]butanoate CAS Name: (2S)-2-ammonio-4-[hydroxy-[(2S)-2-methyl-3-oxido-3-oxopropyl]phosphoryl]butanoate IUPAC Name: (2S)-2-azaniumyl-4-[hydroxy-[(2S)-2-methyl-3-oxido-3-oxopropyl]phosphoryl]butanoate Traditional Name: (2S)-2-ammonio-4-[hydroxy-[(2S)-3-keto-2-methyl-3-oxido-propyl]phosphoryl]butyrate Formula: C8H15NO6P- MolecularWeight: 252.181561

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Descriptors Computed from Structure

Canonical SMILES:

CC(CP(=O)(CCC(C(=O)[O-])[NH3+])O)C(=O)[O-]

Isomeric SMILES

C[C@H](CP(=O)(CC[C@@H](C(=O)[O-])[NH3+])O)C(=O)[O-]

InChI

InChI=1S/C8H16NO6P/c1-5(7(10)11)4-16(14,15)3-2-6(9)8(12)13/h5-6H,2-4,9H2,1H3,(H,10,11)(H,12,13)(H,14,15)/p-1/t5-,6+/m1/s1