Calcium D-gluconate monohydrate

Analyte Name

Calcium Gluconate Monohydrate

CAS Number

66905-23-5

Molecular Formula

2 C6 H11 O7 . Ca . H2 O

Molecular Weight

448.39

Accurate Mass

448.0741

SMILES

O.[Ca+2].OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)C(=O)[O-].OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)C(=O)[O-]

InChI

+2, 1H2/q, /h2*2-5,7-11H,1H2,(H,12,13), , , /m11../s1, InChI=1S/2C6H12O7.Ca.H2O/c2*7-1-2(8)3(9)4(10)5(11)6(12)13, , /p-2/t2*2-,3-,4+,5-,

IUPAC

calcium;(2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoate;hydrate

Alternate CAS Number

Anhydrous free acid: 526-95-4

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

API Family

Calcium