Phytin

CAS Registry Number®

3615-82-5

CAS Name

Phytin

Molecular Formula

C6H18O24P6.xCa.xMg

Cite this Page

Phytin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=3615-82-5 (retrieved 2024-11-23) (CAS RN: 3615-82-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1/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);;/t1-,2-,3-,4+,5-,6-;;

InChIKey

InChIKey=JGBZRJFTDUJBPH-XPJYOAAYNA-N

SMILES

O(P(=O)(O)O)[C@H]1[C@@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O.[Ca].[Mg]

Canonical SMILES

[Mg].[Ca].O=P(O)(O)OC1C(OP(=O)(O)O)C(OP(=O)(O)O)C(OP(=O)(O)O)C(OP(=O)(O)O)C1OP(=O)(O)O

Other Names for this Substance

  • myo-Inositol, 1,2,3,4,5,6-hexakis(dihydrogen phosphate), calcium magnesium salt (1:?:?)
  • Inositol, hexakis(dihydrogen phosphate) calcium magnesium salt, myo-
  • Phytin
  • myo-Inositol, hexakis(dihydrogen phosphate), calcium magnesium salt
  • Eviunis

View All

Deleted or Replaced CAS Registry Numbers

16059-99-7

CAS INSIGHTSTM
Hourglass and a clock