Calcium gluconate

C12H22CaO14CAS 18016-24-5430.37 g/mol

Open in Covalent MOL file
O−OOHOHOHOHOHO−OOHOHOHOHOHCa2+
AlcoholCarboxylic acid

Properties

Molecular formula
C12H22CaO14
Molar mass
430.37 g/mol
Exact mass
430.0635 Da
Melting point
120 °C
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

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
18016-24-5
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.[Ca+2]
InChI

The InChI we hold for this record describes the parent acid and the metal separately rather than the salt above, so it is not shown here.

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Names and synonyms

16 names · show all
  • D-Gluconic acid, calcium salt (2:1)
  • Gluconic acid, calcium salt (2:1), D-
  • Calciofon
  • Calglucon
  • Glucobiogen
  • Ebucin
  • Glucal
  • Calcium D-gluconate
  • Kalpren
  • Dragocal
  • Calcipur
  • Novocal
  • Calglucol
  • Calcium hexagluconate
  • Calcicol
  • Biocal

Work with Calcium 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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Calcium gluconate monohydrate66905-23-5Hydrate Gluconic acid526-95-4Free acid Iron(II) gluconate299-29-6Salt, stereo not defined Chlorhexidine gluconate18472-51-0Salt Sodium gluconate527-07-1Salt Zinc gluconate4468-02-4Salt, stereo not defined Magnesium gluconate3632-91-5Salt Potassium gluconate299-27-4Salt Bis(D-gluconato-kappaO1,kappaO2)copper527-09-3Salt Ferrous gluconate dihydrate12389-15-0Salt, stereo not defined Manganese gluconate6485-39-8Salt, stereo not defined D-Gluconic acid, iron(2+) salt, hydrate (2:1:2)22830-45-1Salt

Similar compounds

D-Arabinonic acid, calcium salt (2:1)22373-09-793 % similar Sodium α-glucoheptonate13007-85-779 % similar Sodium glucoheptonate31138-65-579 % similar Calcium L-threonate70753-61-677 % similar Calcium saccharate5793-88-469 % similar L-Threonic acid magnesium salt778571-57-667 % similar Calcium D-saccharate tetrahydrate5793-89-563 % similar Potassium (2R,3R)-2,3,4-trihydroxybutanoate88759-55-162 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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