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

Details

Stereochemistry ACHIRAL
Molecular Formula C4H5O3.Na
Molecular Weight 124.0705
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SODIUM 2-OXOBUTYRATE

SMILES

[Na+].CCC(=O)C([O-])=O

InChI

InChIKey=SUAMAHKUSIHRMR-UHFFFAOYSA-M
InChI=1S/C4H6O3.Na/c1-2-3(5)4(6)7;/h2H2,1H3,(H,6,7);/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula C4H5O3
Molecular Weight 101.0807
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

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:33:06 UTC 2023
Edited
by admin
on Sat Dec 16 08:33:06 UTC 2023
Record UNII
1632PHS2FR
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SODIUM 2-OXOBUTYRATE
Systematic Name English
BUTANOIC ACID, 2-OXO-, SODIUM SALT
Systematic Name English
BUTYRIC ACID, 2-OXO-, SODIUM SALT
Common Name English
Code System Code Type Description
CAS
2013-26-5
Created by admin on Sat Dec 16 08:33:06 UTC 2023 , Edited by admin on Sat Dec 16 08:33:06 UTC 2023
PRIMARY
EPA CompTox
DTXSID60883538
Created by admin on Sat Dec 16 08:33:06 UTC 2023 , Edited by admin on Sat Dec 16 08:33:06 UTC 2023
PRIMARY
PUBCHEM
23673454
Created by admin on Sat Dec 16 08:33:06 UTC 2023 , Edited by admin on Sat Dec 16 08:33:06 UTC 2023
PRIMARY
FDA UNII
1632PHS2FR
Created by admin on Sat Dec 16 08:33:06 UTC 2023 , Edited by admin on Sat Dec 16 08:33:06 UTC 2023
PRIMARY
ECHA (EC/EINECS)
217-937-8
Created by admin on Sat Dec 16 08:33:06 UTC 2023 , Edited by admin on Sat Dec 16 08:33:06 UTC 2023
PRIMARY