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

Details

Stereochemistry RACEMIC
Molecular Formula C18H13NO8S2.2Na
Molecular Weight 481.407
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SODIUM PICOSULFATE, 2,4'-ISOMER

SMILES

[Na+].[Na+].[O-]S(=O)(=O)OC1=CC=C(C=C1)C(C2=CC=CC=N2)C3=C(OS([O-])(=O)=O)C=CC=C3

InChI

InChIKey=BCLUBMNWNDZSHE-UHFFFAOYSA-L
InChI=1S/C18H15NO8S2.2Na/c20-28(21,22)26-14-10-8-13(9-11-14)18(16-6-3-4-12-19-16)15-5-1-2-7-17(15)27-29(23,24)25;;/h1-12,18H,(H,20,21,22)(H,23,24,25);;/q;2*+1/p-2

HIDE SMILES / InChI

Approval Year

Name Type Language
SODIUM PICOSULFATE, 2,4'-ISOMER
Common Name English
2-((RS)-(PYRIDIN-2-YL)(4-(SULFONATOOXY)PHENYL)METHYL)PHENYL DISODIUM SULFATE
Systematic Name English
SODIUM PICOSULFATE IMPURITY C [EP IMPURITY]
Common Name English
Code System Code Type Description
FDA UNII
B01P98VJ95
Created by admin on Sat Dec 16 07:59:10 GMT 2023 , Edited by admin on Sat Dec 16 07:59:10 GMT 2023
PRIMARY
PUBCHEM
129318353
Created by admin on Sat Dec 16 07:59:10 GMT 2023 , Edited by admin on Sat Dec 16 07:59:10 GMT 2023
PRIMARY