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Details

Stereochemistry ABSOLUTE
Molecular Formula C12H23NO4
Molecular Weight 245.3153
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ISOVALERYLCARNITINE

SMILES

CC(C)CC(=O)O[C@H](CC([O-])=O)C[N+](C)(C)C

InChI

InChIKey=IGQBPDJNUXPEMT-SNVBAGLBSA-N
InChI=1S/C12H23NO4/c1-9(2)6-12(16)17-10(7-11(14)15)8-13(3,4)5/h9-10H,6-8H2,1-5H3/t10-/m1/s1

HIDE SMILES / InChI

Molecular Formula C12H23NO4
Molecular Weight 245.3153
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 15:42:39 GMT 2023
Edited
by admin
on Sat Dec 16 15:42:39 GMT 2023
Record UNII
CJS2BGX9TF
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ISOVALERYLCARNITINE
Common Name English
(R)-3-((3-METHYLBUTANOYL)OXY)-4-(TRIMETHYLAMMONIO)BUTANOATE
Systematic Name English
ISOVALERYL L-CARNITINE
Common Name English
1-PROPANAMINIUM, 3-CARBOXY-N,N,N-TRIMETHYL-2-(3-METHYL-1-OXOBUTOXY)-, INNER SALT, (2R)-
Systematic Name English
Code System Code Type Description
CAS
31023-24-2
Created by admin on Sat Dec 16 15:42:39 GMT 2023 , Edited by admin on Sat Dec 16 15:42:39 GMT 2023
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EPA CompTox
DTXSID40953142
Created by admin on Sat Dec 16 15:42:39 GMT 2023 , Edited by admin on Sat Dec 16 15:42:39 GMT 2023
PRIMARY
FDA UNII
CJS2BGX9TF
Created by admin on Sat Dec 16 15:42:39 GMT 2023 , Edited by admin on Sat Dec 16 15:42:39 GMT 2023
PRIMARY
PUBCHEM
169235
Created by admin on Sat Dec 16 15:42:39 GMT 2023 , Edited by admin on Sat Dec 16 15:42:39 GMT 2023
PRIMARY