Glucobionato calcico
calcium;(2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoate;(2R,3R,4R,5R)-2,3,5,6-tetrahydroxy-4-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexanoate;hydrate
Also Known As: CALCIUM GLUBIONATE, hydrate, Neocalglucon, Neo-Calglucon, Calcii glubionas, Glubionate calcium, Glucobionato calcico, Glubionato di calcio, CALCIUM, Glubionate de calcium, calcium glubionate usp, calcium glubionate hydrate, Glubionato di calcio [DCIT], Calcii glubionas [INN-Latin], Glucobionato calcico [INN-Spanish]
| Molecular Formula | C18H34CaO20 |
|---|---|
| Molecular Weight | 610.12695 g/mol |
| LogP | -13.04 |
| Topological Polar Surface Area | 393.21 Ų |
| Hydrogen Bond Donors | 13 |
| Hydrogen Bond Acceptors | 19 |
| Rotatable Bonds | 13 |
| Exact Mass | 610.12695 |
| Heavy Atoms | 39 |
| Complexity | 685 |
Chemical Identifiers
| CAS Number | 12569-38-9 |
|---|---|
| SMILES | C([C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)O[C@H]([C@@H](CO)O)[C@@H]([C@H](C(=O)[O-])O)O)O)O)O)O.C([C@H]([C@H]([C@@H]([C@H](C(=O)[O-])O)O)O)O)O.O.[Ca+2] |
Product Overview
Glucobionato calcico (CAS 12569-38-9), with molecular formula C18H34CaO20 and molecular weight 610.12695 g/mol. IUPAC: calcium;(2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoate;(2R,3R,4R,5R)-2,3,5,6-tetrahydroxy-4-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexanoate;hydrate.
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