Ketcher 03011616072D 1   1.00000     0.00000     0

 14 12  0     0  0            999 V2000
   11.0403   -5.7791    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1744   -6.2791    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3083   -5.7791    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0403   -4.7791    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9064   -6.2791    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7725   -5.7791    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0403   -6.7791    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.3083   -4.7791    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4423   -6.2791    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.7725   -4.7791    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.6385   -6.2791    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.1744   -4.2791    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9064   -4.2791    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.1098   -3.4555    0.0000 Mg  0  0  0  0  0  0  0  0  0  0  0  0
  6  5  1  0     0  0
  5  1  1  0     0  0
  1  7  1  0     0  0
  1  2  1  0     0  0
  2  3  1  0     0  0
  1  4  1  0     0  0
  4 12  1  0     0  0
  3  9  1  0     0  0
  6 11  1  0     0  0
  6 10  2  0     0  0
  4 13  2  0     0  0
  3  8  2  0     0  0
M  CHG  3   9  -1  11  -1  14   2
M  END
> <ID>
CHEBI:131389

> <NAME>
magnesium citrate

> <DEFINITION>
A magnesium salt composed of magnesium and dibasic citrate ions in a 1:1 ratio.

> <STAR>
3

> <SYNONYM>
Magnesium hydrogen citrate; Magnesium citrate dibasic; E345

> <IUPAC_NAME>
magnesium 3-carboxy-3-hydroxypentanedioate

> <FORMULA>
C6H6MgO7

> <MASS>
214.413

> <MONOISOTOPIC_MASS>
213.99639

> <CHARGE>
0

> <SMILES>
C(CC([O-])=O)(O)(CC([O-])=O)C(O)=O.[Mg+2]

> <INCHI>
InChI=1S/C6H8O7.Mg/c7-3(8)1-6(13,5(11)12)2-4(9)10;/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);/q;+2/p-2

> <INCHIKEY>
DIXGJWCZQHXZNR-UHFFFAOYSA-L

> <CAS_REGISTRY_NUMBER>
144-23-0

> <REAXYS_REGISTRY_NUMBER>
15570024

> <CHEMIDPLUS>
144-23-0

> <WIKIPEDIA_ACCESSION>
Magnesium_citrate

> <PUBMED_CITATION>
26272858; 26751113; 26818765; 26886637

$$$$