U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C6H6O24P6.5Ca.Mg
Molecular Weight 872.635
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PHYTIN

SMILES

[Mg++].[Ca++].[Ca++].[Ca++].[Ca++].[Ca++].[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

InChI

InChIKey=HYZKUQIQEQQXOQ-BQYPOXACSA-B
InChI=1S/C6H18O24P6.5Ca.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);;;;;;/q;6*+2/p-12/t1-,2-,3-,4+,5-,6-;;;;;;

HIDE SMILES / InChI

Molecular Formula Mg
Molecular Weight 24.305
Charge 2
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C6H6O24P6
Molecular Weight 647.94
Charge -12
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 6 / 6
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula Ca
Molecular Weight 40.078
Charge 2
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Epigenetics, an early event in the modulation of gene expression by inositol hexaphosphate in ethylnitrosourea exposed mouse lungs.
2011
Coexpression of fungal phytase and xylanase utilizing the cis-acting hydrolase element in Pichia pastoris.
2010-11
The role of soy in vegetarian diets.
2010-08
The structure of Aspergillus niger phytase PhyA in complex with a phytate mimetic.
2010-07-09
Polyphenol-rich beverages enhance zinc uptake and metallothionein expression in Caco-2 cells.
2010-05
Yogurt protects against growth retardation in weanling rats fed diets high in phytic acid.
2010-02
Iron absorption from brown rice/brown rice-based meal and milled rice/milled rice-based meal.
2009-12
Inositol pyrophosphates: structure, enzymology and function.
2009-12
Phytochemical profiles and health-promoting effects of cool-season food legumes as influenced by thermal processing.
2009-11-25
Screening, selection and characterization of phytic acid degrading lactic acid bacteria from chicken intestine.
2009-07-31
New sources of soybean seed meal and oil composition traits identified through TILLING.
2009-07-14
Mutations of the multi-drug resistance-associated protein ABC transporter gene 5 result in reduction of phytic acid in rice seeds.
2009-06
Novel irinotecan-loaded liposome using phytic acid with high therapeutic efficacy for colon tumors.
2009-05-21
Effect of Soybean Hypocotyl Extract on Lipid Peroxidation in GK Rats.
2009-05
Heat Shock Protein-27, -60 and -90 expression in gastric cancer: association with clinicopathological variables and patient survival.
2009-02-09
Pulque, an alcoholic drink from rural Mexico, contains phytase. Its in vitro effects on corn tortilla.
2008-12
Energy and macronutrient intakes in preschool children in urban areas of Ho Chi Minh City, Vietnam.
2008-10-18
In vitro tooth whitening effect of two medicated chewing gums compared to a whitening gum and saliva.
2008-08-11
Effector-induced structural fluctuation regulates the ligand affinity of an allosteric protein: binding of inositol hexaphosphate has distinct dynamic consequences for the T and R states of hemoglobin.
2008-04-29
Treatment of zinc deficiency without zinc fortification.
2008-03
[Calcium kidney stones. Diagnostic and preventive prospects].
2008-02-19
Requirement of inositol pyrophosphates for full exocytotic capacity in pancreatic beta cells.
2007-11-23
The effect of phytase and glucanase on the ileal digestible energy of corn and soybean meal fed to broilers.
2007-11
Impact of sourdough on the texture of bread.
2007-04
Autocatalytic cleavage of Clostridium difficile toxin B.
2007-03-22
Transporters of ligands for essential metal ions in plants.
2007
A revised model for studying phosphorus and calcium kinetics in growing sheep.
2006-10
Characterization of myo-inositol hexakisphosphate deposits from larval Echinococcus granulosus.
2006-07
Aspergillus niger pH 2.1 optimum acid phosphatase with high affinity for phytate.
2006
Analysis of oxygen binding by hemoglobin on the basis of mean intrinsic thermodynamic quantities.
2006
Phytic acid-induced metabolic changes in the rat.
2005-12
Quaternary structures of intermediately ligated human hemoglobin a and influences from strong allosteric effectors: resonance Raman investigation.
2005-08
Recent development of sentinel lymph node biopsy for breast cancer in Japan.
2004-10
An antagonist of retinoic acid receptors more effectively inhibits growth of human prostate cancer cells than normal prostate epithelium.
2004-08-02
Influence of dietary calcium and phytase on phytate phosphorus hydrolysis in broiler chickens.
2004-08
Isolation, characterization, and molecular cloning of the cDNA encoding a novel phytase from Aspergillus niger 113 and high expression in Pichia pastoris.
2004-05-31
Phosphorus fractionation in manure from swine fed traditional and low-phytate corn diets.
2004-02-18
Acid phosphatase activities during the germination of Glycine max seeds.
2004-01
Purification and properties of a low-molecular-weight phytase from Cladosporium sp. FP-1.
2004
Effectiveness of twenty-five-hydroxycholecalciferol in the prevention of tibial dyschondroplasia in Ross cockerels depends on dietary calcium level.
2003-11
Phytate as the sole phosphate source for growth of Tetrahymena.
2002-11-12
Molecular and biochemical characterization of two plant inositol polyphosphate 6-/3-/5-kinases.
2002-11-08
The development of feedstuff retainable phosphorus values for broilers.
2002-11
Transport of the highly charged myo-inositol hexakisphosphate molecule across the red blood cell membrane: a phase transfer and biological study.
2002-09
Cloning and characterisation of hAps1 and hAps2, human diadenosine polyphosphate-metabolising Nudix hydrolases.
2002-07-16
Fractionation of phosphorus and trace elements species in soybean flour and common white bean seeds by size exclusion chromatography-inductively coupled plasma mass spectrometry.
2002-04-25
Specific interaction of IP6 with human Ku70/80, the DNA-binding subunit of DNA-PK.
2002-04-15
Can dietary treatment of non-anemic iron deficiency improve iron status?
2001-10
Processing of newly released ricebean and fababean cultivars: changes in total and available calcium, iron and phosphorus.
2001-09
Partial characterization of the cross-reacting determinant, a carbohydrate epitope shared by decay accelerating factor and the variant surface glycoprotein of the African Trypanosoma brucei.
1988-03-15
Patents
Substance Class Chemical
Created
by admin
on Mon Mar 31 17:48:02 GMT 2025
Edited
by admin
on Mon Mar 31 17:48:02 GMT 2025
Record UNII
N1DEP08LNK
Record Status Validated (UNII)
Record Version
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Name Type Language
FYTATE CALCIUM MAGNESIUM
WHO-DD  
Preferred Name English
PHYTIN
INCI   VANDF  
INCI  
Official Name English
INOSITOL HEXAPHOSPHORIC ACID, CALCIUM-MAGNESIUM SALT
Common Name English
PHYTIC ACID CALCIUM MAGNESIUM SALT
MI  
Common Name English
CALCIUM MAGNESIUM FYTATE [MART.]
Common Name English
PHYTIN [VANDF]
Common Name English
Fytate calcium magnesium [WHO-DD]
Common Name English
MYO-INOSITOL, HEXAKIS(DIHYDROGEN PHOSPHATE), CALCIUM MAGNESIUM SALT
Common Name English
MYO-INOSITOL, HEXAKIS(DIHYDROGEN PHOSPHATE), CALCIUM MAGNESIUM SALT (1:5:1)
Systematic Name English
CALCIUM-MAGNESIUM PHYTATE
Common Name English
MAGNESIUM PENTACALCIUM PHYTATE
Common Name English
PHYTIC ACID CALCIUM MAGNESIUM SALT [MI]
Common Name English
CALCIUM MAGNESIUM FYTATE
MART.  
Common Name English
Code System Code Type Description
CAS
3615-82-5
Created by admin on Mon Mar 31 17:48:02 GMT 2025 , Edited by admin on Mon Mar 31 17:48:02 GMT 2025
NON-SPECIFIC STOICHIOMETRY
EVMPD
SUB02293MIG
Created by admin on Mon Mar 31 17:48:02 GMT 2025 , Edited by admin on Mon Mar 31 17:48:02 GMT 2025
PRIMARY
ECHA (EC/EINECS)
222-798-1
Created by admin on Mon Mar 31 17:48:02 GMT 2025 , Edited by admin on Mon Mar 31 17:48:02 GMT 2025
PRIMARY
WIKIPEDIA
Phytin
Created by admin on Mon Mar 31 17:48:02 GMT 2025 , Edited by admin on Mon Mar 31 17:48:02 GMT 2025
PRIMARY
PUBCHEM
76963969
Created by admin on Mon Mar 31 17:48:02 GMT 2025 , Edited by admin on Mon Mar 31 17:48:02 GMT 2025
PRIMARY
FDA UNII
N1DEP08LNK
Created by admin on Mon Mar 31 17:48:02 GMT 2025 , Edited by admin on Mon Mar 31 17:48:02 GMT 2025
PRIMARY
MERCK INDEX
m8769
Created by admin on Mon Mar 31 17:48:02 GMT 2025 , Edited by admin on Mon Mar 31 17:48:02 GMT 2025
PRIMARY Merck Index
CAS
76466-13-2
Created by admin on Mon Mar 31 17:48:02 GMT 2025 , Edited by admin on Mon Mar 31 17:48:02 GMT 2025
PRIMARY
EPA CompTox
DTXSID30891206
Created by admin on Mon Mar 31 17:48:02 GMT 2025 , Edited by admin on Mon Mar 31 17:48:02 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE