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Details

Stereochemistry ACHIRAL
Molecular Formula 2C7H4NO3S.Ca.7H2O
Molecular Weight 530.538
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SACCHARIN CALCIUM

SMILES

O.O.O.O.O.O.O.[Ca++].O=C1[N-]S(=O)(=O)C2=C1C=CC=C2.O=C3[N-]S(=O)(=O)C4=C3C=CC=C4

InChI

InChIKey=NNOYLBKZPCUCQT-UHFFFAOYSA-L
InChI=1S/2C7H5NO3S.Ca.7H2O/c2*9-7-5-3-1-2-4-6(5)12(10,11)8-7;;;;;;;;/h2*1-4H,(H,8,9);;7*1H2/q;;+2;;;;;;;/p-2

HIDE SMILES / InChI

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

Molecular Formula C7H5NO3S
Molecular Weight 183.185
Charge 0
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

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:48:07 UTC 2023
Edited
by admin
on Fri Dec 15 15:48:07 UTC 2023
Record UNII
5101OP7P2I
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SACCHARIN CALCIUM
II   MART.   USP   USP-RS   VANDF  
Common Name English
SACCHARIN CALCIUM [MART.]
Common Name English
SACCHARIN CALCIUM [VANDF]
Common Name English
CALCIUM SACCHARIN [INCI]
Common Name English
1,2-BENZISOTHIAZOL-3(2H)-ONE, 1,1-DIOXIDE, CALCIUM SALT, HYDRATE (4:2:7)
Systematic Name English
SACCHARIN CALCIUM [USP-RS]
Common Name English
CALCIUM SACCHARIN [FCC]
Common Name English
SACCHARIN CALCIUM [USP MONOGRAPH]
Common Name English
HYDRATED SACCHARIN CALCIUM
Common Name English
INS NO.954(II)
Code English
SACCHARIN CALCIUM [II]
Common Name English
CALCIUM SACCHARIN HYDROUS
Common Name English
1,2-BENZISOTHIAZOL-3(2H)-ONE, 1,1-DIOXIDE, CALCIUM SALT, HYDRATE (2:7)
Common Name English
1,2-Benzisothiazolin-3-one 1,1-dioxide calcium salt hydrate (2:7)
Common Name English
E-954(II)
Code English
CALCIUM SACCHARIN
FCC   INCI  
INCI  
Official Name English
INS-954(II)
Code English
CALCIUM O-BENZOLSULFIMIDE HYDRATE
Common Name English
CALCIUM SACCHARIN HYDRATE
Common Name English
SACCHARIN CALCIUM HYDRATE
Common Name English
Classification Tree Code System Code
CODEX ALIMENTARIUS (GSFA) INS-954(II)
Created by admin on Fri Dec 15 15:48:07 UTC 2023 , Edited by admin on Fri Dec 15 15:48:07 UTC 2023
JECFA EVALUATION INS-954(II)
Created by admin on Fri Dec 15 15:48:07 UTC 2023 , Edited by admin on Fri Dec 15 15:48:07 UTC 2023
NCI_THESAURUS C283
Created by admin on Fri Dec 15 15:48:07 UTC 2023 , Edited by admin on Fri Dec 15 15:48:07 UTC 2023
Code System Code Type Description
DAILYMED
5101OP7P2I
Created by admin on Fri Dec 15 15:48:07 UTC 2023 , Edited by admin on Fri Dec 15 15:48:07 UTC 2023
PRIMARY
RS_ITEM_NUM
1607029
Created by admin on Fri Dec 15 15:48:07 UTC 2023 , Edited by admin on Fri Dec 15 15:48:07 UTC 2023
PRIMARY
PUBCHEM
23725013
Created by admin on Fri Dec 15 15:48:07 UTC 2023 , Edited by admin on Fri Dec 15 15:48:07 UTC 2023
PRIMARY
SMS_ID
300000040305
Created by admin on Fri Dec 15 15:48:07 UTC 2023 , Edited by admin on Fri Dec 15 15:48:07 UTC 2023
PRIMARY
DRUG BANK
DBSALT002238
Created by admin on Fri Dec 15 15:48:07 UTC 2023 , Edited by admin on Fri Dec 15 15:48:07 UTC 2023
PRIMARY
ChEMBL
CHEMBL2219732
Created by admin on Fri Dec 15 15:48:07 UTC 2023 , Edited by admin on Fri Dec 15 15:48:07 UTC 2023
PRIMARY
EVMPD
SUB39454
Created by admin on Fri Dec 15 15:48:07 UTC 2023 , Edited by admin on Fri Dec 15 15:48:07 UTC 2023
PRIMARY
RXCUI
1362912
Created by admin on Fri Dec 15 15:48:07 UTC 2023 , Edited by admin on Fri Dec 15 15:48:07 UTC 2023
PRIMARY RxNorm
CAS
6381-91-5
Created by admin on Fri Dec 15 15:48:07 UTC 2023 , Edited by admin on Fri Dec 15 15:48:07 UTC 2023
PRIMARY
NCI_THESAURUS
C80009
Created by admin on Fri Dec 15 15:48:07 UTC 2023 , Edited by admin on Fri Dec 15 15:48:07 UTC 2023
PRIMARY
FDA UNII
5101OP7P2I
Created by admin on Fri Dec 15 15:48:07 UTC 2023 , Edited by admin on Fri Dec 15 15:48:07 UTC 2023
PRIMARY
EPA CompTox
DTXSID5047459
Created by admin on Fri Dec 15 15:48:07 UTC 2023 , Edited by admin on Fri Dec 15 15:48:07 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
ANHYDROUS->SOLVATE