dimagnesium (2S)-5-azanyl-2-[[2-methyl-3-oxidanidyl-5-(phosphonatooxymethyl)pyridin-4-yl]methylideneamino]-5-oxidanylidene-pentanoate

Systemtic Name: dimagnesium (2S)-5-azanyl-2-[[2-methyl-3-oxidanidyl-5-(phosphonatooxymethyl)pyridin-4-yl]methylideneamino]-5-oxidanylidene-pentanoate Openeye Name: dimagnesium (2S)-5-amino-2-[[2-methyl-3-oxido-5-(phosphonatooxymethyl)-4-pyridyl]methyleneamino]-5-oxo-pentanoate CAS Name: dimagnesium (2S)-5-amino-2-[[2-methyl-3-oxido-5-(phosphonatooxymethyl)-4-pyridinyl]methylideneamino]-5-oxopentanoate IUPAC Name: dimagnesium (2S)-5-amino-2-[[2-methyl-3-oxido-5-(phosphonatooxymethyl)pyridin-4-yl]methylideneamino]-5-oxopentanoate Traditional Name: dimagnesium (2S)-5-amino-5-keto-2-[[2-methyl-3-oxido-5-(phosphatomethyl)-4-pyridyl]methyleneamino]valerate Formula: C13H14Mg2N3O8P MolecularWeight: 419.849321

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=C1[O-])C=NC(CCC(=O)N)C(=O)[O-])COP(=O)([O-])[O-].[Mg+2].[Mg+2]

Isomeric SMILES

CC1=NC=C(C(=C1[O-])C=N[C@@H](CCC(=O)N)C(=O)[O-])COP(=O)([O-])[O-].[Mg+2].[Mg+2]

InChI

InChI=1S/C13H18N3O8P.2Mg/c1-7-12(18)9(8(4-15-7)6-24-25(21,22)23)5-16-10(13(19)20)2-3-11(14)17;;/h4-5,10,18H,2-3,6H2,1H3,(H2,14,17)(H,19,20)(H2,21,22,23);;/q;2*+2/p-4/t10-;;/m0../s1