Phytin
CAS Registry Number®
3615-82-5
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CAS Name
PhytinMolecular Formula
C6H18O24P6.xCa.xMgCite 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 ) (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
Deleted or Replaced CAS Registry Numbers
16059-99-7
