70689325
  -OEChem-05251313462D

 31 27  0     1  0  0  0  0  0999 V2000
    5.7331    1.8100    0.0000 K   0  3  0  0  0  0  0  0  0  0  0  0
    1.1162    5.9928    0.0000 Mg  0  2  0  0  0  0  0  0  0  0  0  0
    0.5369    1.8100    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8671    1.3100    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    4.0010    2.8100    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4030    0.3100    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8980    5.3693    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    3.4965    4.8100    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1162    6.9928    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.6755    8.5912    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1350    0.3100    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.3069    6.4928    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.1350    1.3100    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.3069    6.4928    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.2690    1.8100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8730    7.3938    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0010    1.8100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4030    1.3100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8730    5.5918    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8980    7.6163    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6720    1.0000    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6367    5.9678    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6675    2.2849    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8705    2.2849    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4774    7.5317    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8730    8.0138    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5981    0.0000    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6720    0.0000    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6169    7.0297    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6169    5.9559    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.5000    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  3 18  1  0  0  0  0
  3 31  1  0  0  0  0
  4 17  1  0  0  0  0
  5 17  2  0  0  0  0
  6 18  2  0  0  0  0
  7 19  1  0  0  0  0
  8 19  2  0  0  0  0
  9 20  1  0  0  0  0
 10 20  2  0  0  0  0
 13 11  1  1  0  0  0
 11 27  1  0  0  0  0
 11 28  1  0  0  0  0
 14 12  1  6  0  0  0
 12 29  1  0  0  0  0
 12 30  1  0  0  0  0
 13 15  1  0  0  0  0
 13 17  1  0  0  0  0
 13 21  1  0  0  0  0
 14 16  1  0  0  0  0
 14 19  1  0  0  0  0
 14 22  1  0  0  0  0
 15 18  1  0  0  0  0
 15 23  1  0  0  0  0
 15 24  1  0  0  0  0
 16 20  1  0  0  0  0
 16 25  1  0  0  0  0
 16 26  1  0  0  0  0
M  CHG  5   1   1   2   2   4  -1   7  -1   9  -1
M  END
> <PUBCHEM_COMPOUND_CID>
70689325

> <PUBCHEM_COMPOUND_CANONICALIZED>
1

> <PUBCHEM_CACTVS_COMPLEXITY>
249

> <PUBCHEM_CACTVS_HBOND_ACCEPTOR>
10

> <PUBCHEM_CACTVS_HBOND_DONOR>
3

> <PUBCHEM_CACTVS_ROTATABLE_BOND>
3

> <PUBCHEM_CACTVS_SUBSKEYS>
AAADccBzPAAAQCAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAHgAQCAAACCjBgAQACABAAgAIAACQCAAAAAAAAAAAAIGAAAACABgAAAAAQAAGEAAAAABDAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==

> <PUBCHEM_IUPAC_OPENEYE_NAME>
magnesium;potassium;(2S)-2-aminobutanedioate;(2S)-2-amino-4-hydroxy-4-oxo-butanoate

> <PUBCHEM_IUPAC_CAS_NAME>
magnesium;potassium;(2S)-2-aminobutanedioate;(2S)-2-amino-4-hydroxy-4-oxobutanoate

> <PUBCHEM_IUPAC_NAME>
magnesium;potassium;(2S)-2-aminobutanedioate;(2S)-2-amino-4-hydroxy-4-oxobutanoate

> <PUBCHEM_IUPAC_SYSTEMATIC_NAME>
magnesium;potassium;(2S)-2-azanylbutanedioate;(2S)-2-azanyl-4-oxidanyl-4-oxidanylidene-butanoate

> <PUBCHEM_IUPAC_TRADITIONAL_NAME>
magnesium;potassium;(2S)-2-amino-4-hydroxy-4-keto-butyrate;(2S)-2-aminosuccinate

> <PUBCHEM_IUPAC_INCHI>
InChI=1S/2C4H7NO4.K.Mg/c2*5-2(4(8)9)1-3(6)7;;/h2*2H,1,5H2,(H,6,7)(H,8,9);;/q;;+1;+2/p-3/t2*2-;;/m00../s1

> <PUBCHEM_IUPAC_INCHIKEY>
YTMMNVKFROGRME-NVKWYWNSSA-K

> <PUBCHEM_EXACT_MASS>
326.000289

> <PUBCHEM_MOLECULAR_FORMULA>
C8H11KMgN2O8

> <PUBCHEM_MOLECULAR_WEIGHT>
326.58484

> <PUBCHEM_OPENEYE_CAN_SMILES>
C(C(C(=O)[O-])N)C(=O)O.C(C(C(=O)[O-])N)C(=O)[O-].[Mg+2].[K+]

> <PUBCHEM_OPENEYE_ISO_SMILES>
C([C@@H](C(=O)[O-])N)C(=O)O.C([C@@H](C(=O)[O-])N)C(=O)[O-].[Mg+2].[K+]

> <PUBCHEM_CACTVS_TPSA>
210

> <PUBCHEM_MONOISOTOPIC_WEIGHT>
326.000289

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_HEAVY_ATOM_COUNT>
20

> <PUBCHEM_ATOM_DEF_STEREO_COUNT>
2

> <PUBCHEM_ATOM_UDEF_STEREO_COUNT>
0

> <PUBCHEM_BOND_DEF_STEREO_COUNT>
0

> <PUBCHEM_BOND_UDEF_STEREO_COUNT>
0

> <PUBCHEM_ISOTOPIC_ATOM_COUNT>
0

> <PUBCHEM_COMPONENT_COUNT>
4

> <PUBCHEM_CACTVS_TAUTO_COUNT>
1

> <PUBCHEM_COORDINATE_TYPE>
1
5
255

> <PUBCHEM_BONDANNOTATIONS>
13  11  5
14  12  6

$$$$