(Q3746173)

Inositocalcium (English)

20 September 2016

chemical formula

C₆H₆CaMgO₂₄P₆⁸⁻

1 reference

based on heuristic

inferred from SMILES

canonical 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-].[Mg+2].[Ca+2]

1 reference

Inositocalcium (English)

InChI=1S/C6H18O24P6.Ca.Mg/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;2*+2/p-12

20 September 2016

different from

Fitina

0 references

Identifiers

InChI

1 reference

Inositocalcium (English)

JWJNVODPOMYTLT-UHFFFAOYSA-B

20 September 2016

InChIKey

1 reference

Inositocalcium (English)

imported from Wikimedia project

20 September 2016

CAS Registry Number

3615-82-5

1 reference

1 reference

Phosphonate, P,P',P'',P''',P'''',P'''''-[1,2,3,4,5,6-cyclohexanehexaylhexakis(oxy)]hexakis-, calcium magnesium salt (1:1:1) (English)

20 September 2016

1 reference

DSSTOX compound identifier

Inositocalcium (English)

20 September 2016

1 reference

0 references

DTXCID101030403

0 references

EC number

222-798-1

1 reference

imported from Wikimedia project

Italian Wikipedia

ECHA Substance Infocard ID

100.020.726

1 reference

stated in

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.020.726

27 December 2018