Glucobionato calcico
TL;DR: Glucobionato calcico (CAS 12569-38-9) is a chemical compound with molecular formula C18H34CaO20 and molecular weight 610.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
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
| Molecular Formula | C18H34CaO20 |
|---|---|
| Molecular Weight | 610.13 g/mol |
| LogP | -13.04 |
| Topological Polar Surface Area | 363.0 Ų |
| Hydrogen Bond Donors | 14 |
| Hydrogen Bond Acceptors | 20 |
| Rotatable Bonds | 15 |
| Exact Mass | 610.12695 |
| Heavy Atoms | 39 |
| Complexity | 686.0 |
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] |
| InChIKey | OKRXSXDSNLJCRS-NLOQLBMISA-L |
Product Overview
Glucobionato calcico (CAS 12569-38-9), with molecular formula C18H34CaO20 and molecular weight 610.13 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.
Chemical Property Profile of Glucobionato calcico
Property Insights of Glucobionato calcico
The XLogP value of -13.04 indicates that Glucobionato calcico is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 363.0 Ų indicates high polarity, suggesting Glucobionato calcico may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Glucobionato calcico has 14 hydrogen bond donor(s) and 20 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Glucobionato calcico?
The CAS number of Glucobionato calcico is 12569-38-9.
What is the molecular formula of Glucobionato calcico?
The molecular formula of Glucobionato calcico is C18H34CaO20.
What is the molecular weight of Glucobionato calcico?
The molecular weight of Glucobionato calcico is 610.13 g/mol.
Where can I buy Glucobionato calcico?
You can request a quote for Glucobionato calcico directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Glucobionato calcico?
Yes, KEHONG BIO provides custom synthesis services for Glucobionato calcico and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.