Phytic Acid

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 439
Total Number of Articles : 478
PubChem 890
Molecular Formula

C6H18O24P6

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

InChI

InChI=1S/C6H18O24P6/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)

synonyms
  • Phytic acid
  • 83-86-3
  • Fytic acid
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Properties
Property Value
MW 660.04 g/mol
HBD 12
HBA 24
Rotatable Bond Count 12
Exact Mass 659.86137342 g/mol
Monoisotopic Mass 659.86137342 g/mol
Heavy Atom Count 36
Isotope Atom Count 0
Atom Stereo Count 0
Covalent Unit Count 1
Complexity 818
xlogp -10.3
Topological Polar Surface Area 401