chempirical

Magnesium gluconate

C12H22MgO14CAS 3632-91-5414.60 g/mol

Open in Covalent MOL file
O−OOHOHOHOHOHO−OOHOHOHOHOHMg2+
AlcoholCarboxylic acid

Properties

Molecular formula
C12H22MgO14
Molar mass
414.60 g/mol
Exact mass
414.0860 Da
logP
-3.87Crippen estimate
Polar surface area
138.4 Ų
H-bond donors / acceptors
6 / 6
Rotatable bonds
5
Stereocentres
R, S, R, R, R, S, R, Rin SMILES atom order

Identifiers

CAS number
3632-91-5
SMILES
[O-]C(=O)[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO.[O-]C(=O)[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO.[Mg+2]
InChIKey
TVCCGDZFOQVESW-JJKGCWMISA-N
InChI
InChI=1S/C6H12O7.Mg/c7-1-2(8)3(9)4(10)5(11)6(12)13;/h2-5,7-11H,1H2,(H,12,13);/t2-,3-,4+,5-;/m1./s1

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

7 names
  • D-Gluconic acid, magnesium salt (2:1)
  • Gluconic acid, magnesium salt (2:1), D-
  • Almora
  • GYN
  • Menesia
  • Glucomag
  • Glucosium

Work with Magnesium gluconate

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Calcium gluconate18016-24-584 % similar Potassium gluconate299-27-484 % similar Calcium gluconate299-28-584 % similar Iron(II) gluconate299-29-684 % similar Zinc gluconate4468-02-484 % similar Sodium gluconate527-07-184 % similar Bis(D-gluconato-κO1,κO2)copper527-09-384 % similar Manganese gluconate6485-39-884 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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