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

Details

Stereochemistry ACHIRAL
Molecular Formula 2C6H5O7.6Na.11H2O
Molecular Weight 714.3061
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TRISODIUM CITRATE HYDRATE (2:11)

SMILES

O.O.O.O.O.O.O.O.O.O.O.[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].OC(CC([O-])=O)(CC([O-])=O)C([O-])=O.OC(CC([O-])=O)(CC([O-])=O)C([O-])=O

InChI

InChIKey=ILPACMRUIRJCEL-UHFFFAOYSA-H
InChI=1S/2C6H8O7.6Na.11H2O/c2*7-3(8)1-6(13,5(11)12)2-4(9)10;;;;;;;;;;;;;;;;;/h2*13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);;;;;;;11*1H2/q;;6*+1;;;;;;;;;;;/p-6

HIDE SMILES / InChI

Molecular Formula Na
Molecular Weight 22.98976928
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula H2O
Molecular Weight 18.0153
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C6H5O7
Molecular Weight 189.0997
Charge -3
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 22:43:52 GMT 2025
Edited
by admin
on Mon Mar 31 22:43:52 GMT 2025
Record UNII
EQ9CSK6DWG
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Citric acid, trisodium salt, hydrate (2:11)
Preferred Name English
TRISODIUM CITRATE HYDRATE (2:11)
Common Name English
1,2,3-Propanetricarboxylic acid, 2-hydroxy-, sodium salt, hydrate (2:6:11)
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID2040781
Created by admin on Mon Mar 31 22:43:52 GMT 2025 , Edited by admin on Mon Mar 31 22:43:52 GMT 2025
PRIMARY
PUBCHEM
21868242
Created by admin on Mon Mar 31 22:43:52 GMT 2025 , Edited by admin on Mon Mar 31 22:43:52 GMT 2025
PRIMARY
FDA UNII
EQ9CSK6DWG
Created by admin on Mon Mar 31 22:43:52 GMT 2025 , Edited by admin on Mon Mar 31 22:43:52 GMT 2025
PRIMARY
CAS
6858-44-2
Created by admin on Mon Mar 31 22:43:52 GMT 2025 , Edited by admin on Mon Mar 31 22:43:52 GMT 2025
PRIMARY