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Details

Stereochemistry ACHIRAL
Molecular Formula 2C4H8NO4S.Ca
Molecular Weight 372.429
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CALCIUM 3-FORMAMIDOPROPANE-1-SULFONATE

SMILES

[Ca++].[O-]S(=O)(=O)CCCNC=O.[O-]S(=O)(=O)CCCNC=O

InChI

InChIKey=MKGDXDBPQJOURM-UHFFFAOYSA-L
InChI=1S/2C4H9NO4S.Ca/c2*6-4-5-2-1-3-10(7,8)9;/h2*4H,1-3H2,(H,5,6)(H,7,8,9);/q;;+2/p-2

HIDE SMILES / InChI

Molecular Formula C4H8NO4S
Molecular Weight 166.176
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

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

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:21:56 GMT 2023
Edited
by admin
on Sat Dec 16 19:21:56 GMT 2023
Record UNII
56AJK3Y2PG
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CALCIUM 3-FORMAMIDOPROPANE-1-SULFONATE
Common Name English
Acamprosate Related Compound B [USP-RS]
Common Name English
Code System Code Type Description
RS_ITEM_NUM
1000576
Created by admin on Sat Dec 16 19:21:56 GMT 2023 , Edited by admin on Sat Dec 16 19:21:56 GMT 2023
PRIMARY
FDA UNII
56AJK3Y2PG
Created by admin on Sat Dec 16 19:21:56 GMT 2023 , Edited by admin on Sat Dec 16 19:21:56 GMT 2023
PRIMARY
PUBCHEM
166177258
Created by admin on Sat Dec 16 19:21:56 GMT 2023 , Edited by admin on Sat Dec 16 19:21:56 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE