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

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

Approval Year

PubMed

PubMed

TitleDatePubMed
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 Mar 15
Production, purification and properties of microbial phytases.
2001 May
Can dietary treatment of non-anemic iron deficiency improve iron status?
2001 Oct
Processing of newly released ricebean and fababean cultivars: changes in total and available calcium, iron and phosphorus.
2001 Sep
Specific interaction of IP6 with human Ku70/80, the DNA-binding subunit of DNA-PK.
2002 Apr 15
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 Apr 25
Cloning and characterisation of hAps1 and hAps2, human diadenosine polyphosphate-metabolising Nudix hydrolases.
2002 Jul 16
The development of feedstuff retainable phosphorus values for broilers.
2002 Nov
Molecular and biochemical characterization of two plant inositol polyphosphate 6-/3-/5-kinases.
2002 Nov 8
Transport of the highly charged myo-inositol hexakisphosphate molecule across the red blood cell membrane: a phase transfer and biological study.
2002 Sep
Phytate as the sole phosphate source for growth of Tetrahymena.
2002 Sep-Oct
Effectiveness of twenty-five-hydroxycholecalciferol in the prevention of tibial dyschondroplasia in Ross cockerels depends on dietary calcium level.
2003 Nov
Purification and properties of a low-molecular-weight phytase from Cladosporium sp. FP-1.
2004
An antagonist of retinoic acid receptors more effectively inhibits growth of human prostate cancer cells than normal prostate epithelium.
2004 Aug 2
Acid phosphatase activities during the germination of Glycine max seeds.
2004 Jan
Phosphorus fractionation in manure from swine fed traditional and low-phytate corn diets.
2004 Jan-Feb
Isolation, characterization, and molecular cloning of the cDNA encoding a novel phytase from Aspergillus niger 113 and high expression in Pichia pastoris.
2004 May 31
Recent development of sentinel lymph node biopsy for breast cancer in Japan.
2004 Oct
Quaternary structures of intermediately ligated human hemoglobin a and influences from strong allosteric effectors: resonance Raman investigation.
2005 Aug
Phytic acid-induced metabolic changes in the rat.
2005 Dec
A role for rat inositol polyphosphate kinases rIPK2 and rIPK1 in inositol pentakisphosphate and inositol hexakisphosphate production in rat-1 cells.
2005 Jan 14
Apo2L/TRAIL induction and nuclear translocation of inositol hexakisphosphate kinase 2 during IFN-beta-induced apoptosis in ovarian carcinoma.
2005 Jan 15
Aspergillus niger pH 2.1 optimum acid phosphatase with high affinity for phytate.
2006
99mTc-phytate is better than 99mTc-human serum albumin as a radioactive tracer for sentinel lymph node biopsy in breast cancer.
2006
Characterization of myo-inositol hexakisphosphate deposits from larval Echinococcus granulosus.
2006 Jul
A revised model for studying phosphorus and calcium kinetics in growing sheep.
2006 Oct
Transporters of ligands for essential metal ions in plants.
2007
Impact of sourdough on the texture of bread.
2007 Apr
The effect of phytase and glucanase on the ileal digestible energy of corn and soybean meal fed to broilers.
2007 Nov
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 Apr 29
Pulque, an alcoholic drink from rural Mexico, contains phytase. Its in vitro effects on corn tortilla.
2008 Dec
Treatment of zinc deficiency without zinc fortification.
2008 Mar
Energy and macronutrient intakes in preschool children in urban areas of Ho Chi Minh City, Vietnam.
2008 Oct 18
Iron absorption from brown rice/brown rice-based meal and milled rice/milled rice-based meal.
2009 Dec
Inositol pyrophosphates: structure, enzymology and function.
2009 Dec
Heat Shock Protein-27, -60 and -90 expression in gastric cancer: association with clinicopathological variables and patient survival.
2009 Feb 9
New sources of soybean seed meal and oil composition traits identified through TILLING.
2009 Jul 14
Screening, selection and characterization of phytic acid degrading lactic acid bacteria from chicken intestine.
2009 Jul 31
Mutations of the multi-drug resistance-associated protein ABC transporter gene 5 result in reduction of phytic acid in rice seeds.
2009 Jun
A paramutation phenomenon is involved in the genetics of maize low phytic acid1-241 (lpa1-241) trait.
2009 Mar
Effect of Soybean Hypocotyl Extract on Lipid Peroxidation in GK Rats.
2009 May
Novel irinotecan-loaded liposome using phytic acid with high therapeutic efficacy for colon tumors.
2009 May 21
Phytochemical profiles and health-promoting effects of cool-season food legumes as influenced by thermal processing.
2009 Nov 25
The role of soy in vegetarian diets.
2010 Aug
Yogurt protects against growth retardation in weanling rats fed diets high in phytic acid.
2010 Feb
The structure of Aspergillus niger phytase PhyA in complex with a phytate mimetic.
2010 Jul 9
Fructo-oligosaccharides enhance the mineral absorption and counteract the adverse effects of phytic acid in mice.
2010 Mar
Polyphenol-rich beverages enhance zinc uptake and metallothionein expression in Caco-2 cells.
2010 May
Coexpression of fungal phytase and xylanase utilizing the cis-acting hydrolase element in Pichia pastoris.
2010 Nov
Epigenetics, an early event in the modulation of gene expression by inositol hexaphosphate in ethylnitrosourea exposed mouse lungs.
2011
Patents
Substance Class Chemical
Created
by admin
on Fri Dec 15 15:08:48 GMT 2023
Edited
by admin
on Fri Dec 15 15:08:48 GMT 2023
Record UNII
N1DEP08LNK
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
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
FYTATE CALCIUM MAGNESIUM
WHO-DD  
Common Name English
PHYTIN [INCI]
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 Fri Dec 15 15:08:48 GMT 2023 , Edited by admin on Fri Dec 15 15:08:48 GMT 2023
NON-SPECIFIC STOICHIOMETRY
EVMPD
SUB02293MIG
Created by admin on Fri Dec 15 15:08:48 GMT 2023 , Edited by admin on Fri Dec 15 15:08:48 GMT 2023
PRIMARY
ECHA (EC/EINECS)
222-798-1
Created by admin on Fri Dec 15 15:08:48 GMT 2023 , Edited by admin on Fri Dec 15 15:08:48 GMT 2023
PRIMARY
WIKIPEDIA
Phytin
Created by admin on Fri Dec 15 15:08:48 GMT 2023 , Edited by admin on Fri Dec 15 15:08:48 GMT 2023
PRIMARY
PUBCHEM
76963969
Created by admin on Fri Dec 15 15:08:48 GMT 2023 , Edited by admin on Fri Dec 15 15:08:48 GMT 2023
PRIMARY
FDA UNII
N1DEP08LNK
Created by admin on Fri Dec 15 15:08:48 GMT 2023 , Edited by admin on Fri Dec 15 15:08:48 GMT 2023
PRIMARY
MERCK INDEX
m8769
Created by admin on Fri Dec 15 15:08:48 GMT 2023 , Edited by admin on Fri Dec 15 15:08:48 GMT 2023
PRIMARY Merck Index
CAS
76466-13-2
Created by admin on Fri Dec 15 15:08:48 GMT 2023 , Edited by admin on Fri Dec 15 15:08:48 GMT 2023
PRIMARY
EPA CompTox
DTXSID30891206
Created by admin on Fri Dec 15 15:08:48 GMT 2023 , Edited by admin on Fri Dec 15 15:08:48 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE