General
Preferred name
PHYTATE PERSODIUM
Synonyms
Phytic acid (dodecasodium salt hydrate) ()
myo-Inositol, hexakis(dihydrogen phosphate) (dodecasodium salt hydrate) ()
Inositol hexaphosphate (dodecasodium salt hydrate) ()
Phytic acid dodecasodium salt hydrate ()
myo-Inositol, hexakis(dihydrogen phosphate) dodecasodium salt hydrate ()
Inositol hexaphosphate dodecasodium salt hydrate ()
Phytic acid (dodecasodium hydrate) ()
Inositol hexaphosphate (dodecasodium hydrate) ()
SNF472 (dodecasodium hydrate) ()
Dodecasodium phytate ()
Sodium fytate (12:1) ()
P&D ID
PD156190
CAS
17211-15-3
123408-98-0
Tags
available
drug candidate
Probe control
Probe control not defined
Orthogonal probes
0
No orthogonal probes found
Similar probes
0
No structurally similar probes found
Structure
P&D probe-likeness score
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
3
ChEMBL Drugs
MedChem Express Bioactive Compound Library
Other bioactive compounds
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
13
Properties
(calculated by RDKit )
Molecular Weight
923.64
Hydrogen Bond Acceptors
24
Hydrogen Bond Donors
0
Rotatable Bonds
24
Ring Count
1
Aromatic Ring Count
0
cLogP
-1.84
TPSA
268.56
Fraction CSP3
1.0
Chiral centers
0.0
Largest ring
6.0
QED
0.08
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Pathway
Metabolic Enzyme/Protease
Target
Xanthine oxidase
Endogenous Metabolite
Source data
