D-Arabinonic acid, calcium salt (2:1)

C10H18CaO12CAS 22373-09-7370.32 g/mol

Open in Covalent MOL file
O−OOHOHOHOHO−OOHOHOHOHCa2+
AlcoholCarboxylic acid

Properties

Molecular formula
C10H18CaO12
Molar mass
370.32 g/mol
Exact mass
370.0424 Da
logP
-3.23Crippen estimate
Polar surface area
118.2 Ų
H-bond donors / acceptors
5 / 5
Rotatable bonds
4
Stereocentres
S, 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
22373-09-7
SMILES
[O-]C(=O)[C@@H](O)[C@H](O)[C@H](O)CO.[O-]C(=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

2 names
  • Arabinonic acid, calcium salt (2:1), D-
  • NSC 224305

Work with D-Arabinonic acid, calcium salt (2:1)

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 gluconate18016-24-593 % similar Calcium gluconate299-28-593 % similar Calcium gluconate monohydrate66905-23-585 % similar Magnesium gluconate3632-91-578 % similar Calcium L-threonate70753-61-677 % similar Potassium gluconate299-27-476 % similar Iron(II) gluconate299-29-676 % similar Zinc gluconate4468-02-476 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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