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Substance Name: Hexasodium phytate
RN: 34367-89-0
UNII: ZBX50UG81V
InChIKey: DHZIAGCFFSRULK-BQYPOXACSA-H

Molecular Formula

  • C6-H12-O24-P6.6Na

Molecular Weight

  • 791.9208
 
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Names and Synonyms

Name of Substance

  • Hexasodium phytate

Synonyms

  • Hexasodium phytate
  • Inositol, hexakis(dihydrogen phosphate) hexasodium salt, myo-
  • Myo-inositol, hexakis(dihydrogen phosphate), hexasodium salt
  • UNII-ZBX50UG81V

Registry Numbers

CAS Registry Number

  • 34367-89-0

FDA UNII

  • ZBX50UG81V

System Generated Number

  • 0034367890

Structure Descriptors

InChI

1S/C6H18O24P6.6Na/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*+1/p-6/t1-,2-,3-,4+,5-,6-;;;;;;

InChIKey

DHZIAGCFFSRULK-BQYPOXACSA-H

Smiles

[C@@H]1([C@@H]([C@@H]([C@@H]([C@H]([C@@H]1OP(=O)([O-])O)OP(=O)([O-])O)OP(=O)([O-])O)OP(=O)([O-])O)OP(=O)([O-])O)OP(=O)([O-])O.[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]