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Details

Stereochemistry ACHIRAL
Molecular Formula C4H10NO6P.Ba
Molecular Weight 336.426
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-Amino-3-hydroxy-2-(hydroxymethyl)propyl Phosphate Barium Salt

SMILES

[Ba++].NC(CO)(CO)COP([O-])([O-])=O

InChI

InChIKey=MQGUHTRENKNMLF-UHFFFAOYSA-L
InChI=1S/C4H12NO6P.Ba/c5-4(1-6,2-7)3-11-12(8,9)10;/h6-7H,1-3,5H2,(H2,8,9,10);/q;+2/p-2

HIDE SMILES / InChI

Molecular Formula C4H10NO6P
Molecular Weight 199.0991
Charge -2
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula Ba
Molecular Weight 137.327
Charge 2
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 Wed Apr 02 19:47:23 GMT 2025
Edited
by admin
on Wed Apr 02 19:47:23 GMT 2025
Record UNII
M8G33F6FHX
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,3-Propanediol, 2-amino-2-(hydroxymethyl)-, phosphate, barium salt
Preferred Name English
2-Amino-3-hydroxy-2-(hydroxymethyl)propyl Phosphate Barium Salt
Systematic Name English
Code System Code Type Description
CAS
114252-50-5
Created by admin on Wed Apr 02 19:47:23 GMT 2025 , Edited by admin on Wed Apr 02 19:47:23 GMT 2025
PRIMARY
PUBCHEM
131637252
Created by admin on Wed Apr 02 19:47:23 GMT 2025 , Edited by admin on Wed Apr 02 19:47:23 GMT 2025
PRIMARY
FDA UNII
M8G33F6FHX
Created by admin on Wed Apr 02 19:47:23 GMT 2025 , Edited by admin on Wed Apr 02 19:47:23 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE