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Details

Stereochemistry ACHIRAL
Molecular Formula C2H3O7P2.5K.H2O
Molecular Weight 414.4953
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ETIDRONATE PENTAPOTASSIUM MONOHYDRATE

SMILES

O.[K+].[K+].[K+].[K+].[K+].CC([O-])(P([O-])([O-])=O)P([O-])([O-])=O

InChI

InChIKey=RMSDSVZYUKCACX-UHFFFAOYSA-J
InChI=1S/C2H7O7P2.5K.H2O/c1-2(3,10(4,5)6)11(7,8)9;;;;;;/h1H3,(H2,4,5,6)(H2,7,8,9);;;;;;1H2/q-1;5*+1;/p-4

HIDE SMILES / InChI
Molecular Formula K
Molecular Weight 39.0983
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE
Molecular Formula HO
Molecular Weight 17.0073
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE
Molecular Formula C2H4O7P2
Molecular Weight 201.9965
Charge -4
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Description

Tetrapotassium Etidronate is the diphosphonic acid derivative. It is used in cosmetics as chelating agent.

Approval Year

Unknown
139594
Conditions

Conditions

ConditionModalityTargetsHighest PhaseProduct
Patents

Patents

EP2843034A1
6
WO2006072385A1
6
WO2014150891A1
6

Sample Use Guides

In Vivo Use Guide
Tetrapotassium Etidronate 0.097% as a component of bath soaps and detergents
Route of Administration: Transdermal
In Vitro Use Guide
Unknown
Substance Class Chemical
Created
by admin
on Sat Dec 16 15:39:58 UTC 2023
Edited
by admin
on Sat Dec 16 15:39:58 UTC 2023
Record UNII
FF53VF097S
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ETIDRONATE PENTAPOTASSIUM MONOHYDRATE
Common Name English
PHOSPHONIC ACID, (1-HYDROXYETHYLIDENE)BIS-, PENTAPOTASSIUM SALT, MONOHYDRATE
Systematic Name English
Code System Code Type Description
FDA UNII
FF53VF097S
Created by admin on Sat Dec 16 15:39:58 UTC 2023 , Edited by admin on Sat Dec 16 15:39:58 UTC 2023
PRIMARY
CAS
87977-58-0
Created by admin on Sat Dec 16 15:39:58 UTC 2023 , Edited by admin on Sat Dec 16 15:39:58 UTC 2023
PRIMARY
PUBCHEM
122201225
Created by admin on Sat Dec 16 15:39:58 UTC 2023 , Edited by admin on Sat Dec 16 15:39:58 UTC 2023
PRIMARY
EPA CompTox
DTXSID8029816
Created by admin on Sat Dec 16 15:39:58 UTC 2023 , Edited by admin on Sat Dec 16 15:39:58 UTC 2023
PRIMARY
Related Record Type Details
Structure of ETIDRONIC ACID
PARENT -> SALT/SOLVATE
NIH
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