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Details

Stereochemistry RACEMIC
Molecular Formula C4H4O4S.Na.H
Molecular Weight 172.135
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SODIUM THIOMALATE

SMILES

[H+].[Na+].[O-]C(=O)CC(S)C([O-])=O

InChI

InChIKey=WGIKUIATRROGSN-UHFFFAOYSA-M
InChI=1S/C4H6O4S.Na/c5-3(6)1-2(9)4(7)8;/h2,9H,1H2,(H,5,6)(H,7,8);/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula C4H4O4S
Molecular Weight 148.137
Charge -2
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

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 H
Molecular Weight 1.0079
Charge 1
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 15:58:32 UTC 2023
Edited
by admin
on Fri Dec 15 15:58:32 UTC 2023
Record UNII
01IZ7O54VH
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SODIUM THIOMALATE
II  
Systematic Name English
BA 51-090255
Code English
SUCCINIC ACID, MERCAPTO-, MONOSODIUM SALT
Common Name English
THIOMALATE SODIUM
WHO-DD  
Systematic Name English
SODIUM THIOMALATE [II]
Common Name English
Thiomalate sodium [WHO-DD]
Common Name English
BUTANEDIOIC ACID, 2-MERCAPTO-, SODIUM SALT (1:1)
Common Name English
BUTANEDIOIC ACID, MERCAPTO-, MONOSODIUM SALT
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID00952616
Created by admin on Fri Dec 15 15:58:32 UTC 2023 , Edited by admin on Fri Dec 15 15:58:32 UTC 2023
PRIMARY
CAS
30245-51-3
Created by admin on Fri Dec 15 15:58:32 UTC 2023 , Edited by admin on Fri Dec 15 15:58:32 UTC 2023
PRIMARY
PUBCHEM
23707083
Created by admin on Fri Dec 15 15:58:32 UTC 2023 , Edited by admin on Fri Dec 15 15:58:32 UTC 2023
PRIMARY
EVMPD
SUB15538MIG
Created by admin on Fri Dec 15 15:58:32 UTC 2023 , Edited by admin on Fri Dec 15 15:58:32 UTC 2023
PRIMARY
SMS_ID
100000077016
Created by admin on Fri Dec 15 15:58:32 UTC 2023 , Edited by admin on Fri Dec 15 15:58:32 UTC 2023
PRIMARY
FDA UNII
01IZ7O54VH
Created by admin on Fri Dec 15 15:58:32 UTC 2023 , Edited by admin on Fri Dec 15 15:58:32 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY