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Details

Stereochemistry RACEMIC
Molecular Formula C8H14O3
Molecular Weight 158.195
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-KETOVALPROIC ACID

SMILES

CCCC(C(O)=O)C(=O)CC

InChI

InChIKey=PPYHXKUZTSZTQU-UHFFFAOYSA-N
InChI=1S/C8H14O3/c1-3-5-6(8(10)11)7(9)4-2/h6H,3-5H2,1-2H3,(H,10,11)

HIDE SMILES / InChI

Molecular Formula C8H14O3
Molecular Weight 158.195
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 13:44:25 GMT 2023
Edited
by admin
on Sat Dec 16 13:44:25 GMT 2023
Record UNII
HIZ0PV4PQ1
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-KETOVALPROIC ACID
Common Name English
3-OXOVALPROIC ACID
Common Name English
3-OXODIPROPYLACETIC ACID
Common Name English
PENTANOIC ACID, 3-OXO-2-PROPYL-
Systematic Name English
3-OXO-2-PROPYLPENTANOIC ACID
Systematic Name English
Code System Code Type Description
CAS
60113-81-7
Created by admin on Sat Dec 16 13:44:26 GMT 2023 , Edited by admin on Sat Dec 16 13:44:26 GMT 2023
PRIMARY
FDA UNII
HIZ0PV4PQ1
Created by admin on Sat Dec 16 13:44:26 GMT 2023 , Edited by admin on Sat Dec 16 13:44:26 GMT 2023
PRIMARY
PUBCHEM
173719
Created by admin on Sat Dec 16 13:44:26 GMT 2023 , Edited by admin on Sat Dec 16 13:44:26 GMT 2023
PRIMARY
EPA CompTox
DTXSID60975543
Created by admin on Sat Dec 16 13:44:26 GMT 2023 , Edited by admin on Sat Dec 16 13:44:26 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE