sodium glucaspaldrate

More details:

• Systematic name

  Aluminium sodium acetate 2-oxidobenzoate (2R,3S,4R,5R)-2,4,5,6-tetrahydroxy-3-oxidohexanoate hydrate (1:4:1:1:2:1) (non-preferred name)

• SMILES

  CC(=O)[O-].CC(=O)[O-].c1ccc(c(c1)C(=O)[O-])[O-].c1ccc(c(c1)C(=O)[O-])[O-].C([C@H]([C@H]([C@@H]([C@H](C(=O)[O-])O)[O-])O)O)O.C([C@H]([C@H]([C@@H]([C@H](C(=O)[O-])O)[O-])O)O)O.C([C@H]([C@H]([C@@H]([C@H](C(=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.O.[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Al+3].[Al+3]

• Std. InChi

  InChI=1S/2C7H6O3.4C6H11O7.2C2H4O2.2Al.8Na.2H2O/c2*8-6-4-2-1-3-5(6)7(9)10;4*7-1-2(8)3(9)4(10)5(11)6(12)13;2*1-2(3)4;;;;;;;;;;;;/h2*1-4,8H,(H,9,10);4*2-5,7-9,11H,1H2,(H,12,13);2*1H3,(H,3,4);;;;;;;;;;;2*1H2/q;;4*-1;;;2*+3;8*+1;;/p-10/t;;4*2-,3-,4+,5-;;;;;;;;;;;;;;/m..1111............../s1

• Std. InChIKey

  IKWYCEXOUZJNKB-WKXRXYJVSA-D

• Cite this record

  CSID:34990500, http://www.chemspider.com/Chemical-Structure.34990500.html (accessed 09:12, Apr 25, 2024)