Inositol hexaphosphate calcium salt

Phytic Acid Complexing agent for removal of traces of heavy metal ions. It acts also as a hypocalcemic agent.

Molecular Formula: C₆H₆Ca₆O₂₄P₆

InChI: InChI=1/C6H18O24P6.6Ca/c7-31(8,9)25-1-2(26-32(10,11)12)4(28-34(16,17)18)6(30-36(22,23)24)5(29-35(19,20)21)3(1)27-33(13,14)15;;;;;;/h1-6H,(H2,7,8,9)(H2,10,11,12)(H2,13,14,15)(H2,16,17,18)(H2,19,20,21)(H2,22,23,24);;;;;;/q;6*+2/p-12/fC6H6O24P6.6Ca/q-12;6m

InChIKey: InChIKey=WPEXVRDUEAJUGY-OCHBVZSQCV
SMILES: C1(C(C(C(C(C1OP(=O)([O-])[O-])OP(=O)([O-])[O-])OP(=O)([O-])[O-])OP(=O)([O-])[O-])OP(=O)([O-])[O-])OP(=O)([O-])[O-].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2]

Names:
    Calcium fytate
    CALCIUM PHYTATE
    EINECS 231-897-9
    hexacalcium dioxido-oxo-(2,3,4,5,6-pentaphosphonatooxycyclohexyl)oxy-phosphorane
    Hexacalcium phytate
    HSDB 962
    Inositol hexaphosphate calcium salt
    Inositol, hexakis(dihydrogen phosphate) calcium salt(1:6), myo-
    Inositol, hexakis(dihydrogen phosphate), calcium salt (1:6), myo-
    Myo-inositol, hexakis(dihydrogen phosphate), calcium salt (1:6)
    7776-28-5

Registries:
    PubChem CID 24495
    PubChem ID 167005