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Details

Stereochemistry RACEMIC
Molecular Formula C18H20N3O3S.Na.H2O
Molecular Weight 399.44
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of RABEPRAZOLE SODIUM MONOHYDRATE

SMILES

O.[Na+].COCCCOC1=CC=NC(C[S+]([O-])C2=NC3=C([N-]2)C=CC=C3)=C1C

InChI

InChIKey=HKZVUFAIQCTTTD-UHFFFAOYSA-N
InChI=1S/C18H20N3O3S.Na.H2O/c1-13-16(19-9-8-17(13)24-11-5-10-23-2)12-25(22)18-20-14-6-3-4-7-15(14)21-18;;/h3-4,6-9H,5,10-12H2,1-2H3;;1H2/q-1;+1;

HIDE SMILES / InChI

Molecular Formula HO
Molecular Weight 17.0073
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula Na
Molecular Weight 22.9898
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C18H21N3O3S
Molecular Weight 359.443
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 Sat Dec 16 01:36:03 UTC 2023
Edited
by admin
on Sat Dec 16 01:36:03 UTC 2023
Record UNII
5XH0X84AHJ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
RABEPRAZOLE SODIUM MONOHYDRATE
Common Name English
1H-BENZIMIDAZOLE, 2-(((4-(3-METHOXYPROPOXY)-3-METHYL-2-PYRIDINYL)METHYL)SULFINYL)-, SODIUM SALT, HYDRATE (1:1:1)
Common Name English
Code System Code Type Description
CAS
1033853-22-3
Created by admin on Sat Dec 16 01:36:03 UTC 2023 , Edited by admin on Sat Dec 16 01:36:03 UTC 2023
PRIMARY
SMS_ID
100000175197
Created by admin on Sat Dec 16 01:36:03 UTC 2023 , Edited by admin on Sat Dec 16 01:36:03 UTC 2023
PRIMARY
FDA UNII
5XH0X84AHJ
Created by admin on Sat Dec 16 01:36:03 UTC 2023 , Edited by admin on Sat Dec 16 01:36:03 UTC 2023
PRIMARY
PUBCHEM
71587910
Created by admin on Sat Dec 16 01:36:03 UTC 2023 , Edited by admin on Sat Dec 16 01:36:03 UTC 2023
PRIMARY
Related Record Type Details
ANHYDROUS->SOLVATE
PARENT -> SALT/SOLVATE