U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS
This repository is under review for potential modification in compliance with Administration directives.

Details

Stereochemistry ABSOLUTE
Molecular Formula C6H14N2O2.C6H10O3
Molecular Weight 276.3294
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of LYSINE KETOISOCAPROATE

SMILES

CC(C)CC(=O)C(O)=O.NCCCC[C@H](N)C(O)=O

InChI

InChIKey=AZOLWFLKEMTKDO-JEDNCBNOSA-N
InChI=1S/C6H14N2O2.C6H10O3/c7-4-2-1-3-5(8)6(9)10;1-4(2)3-5(7)6(8)9/h5H,1-4,7-8H2,(H,9,10);4H,3H2,1-2H3,(H,8,9)/t5-;/m0./s1

HIDE SMILES / InChI

Molecular Formula C6H10O3
Molecular Weight 130.1418
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C6H14N2O2
Molecular Weight 146.1876
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 Mon Mar 31 21:04:34 GMT 2025
Edited
by admin
on Mon Mar 31 21:04:34 GMT 2025
Record UNII
4TJZ858QD3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
KETOLEUCINE LYSINE SALT
Preferred Name English
LYSINE KETOISOCAPROATE
Common Name English
L-LYSINE .ALPHA.-KETOISOCAPROATE
Systematic Name English
L-LYSINE MONO(4-METHYL-2-OXOVALERATE)
Systematic Name English
L-LYSINE, MONO(4-METHYL-2-OXOPENTANOATE)
Systematic Name English
LYSINE, L-, 4-METHYL-2-OXOPENTANOATE
Systematic Name English
PENTANOIC ACID, 4-METHYL-2-OXO-, COMPD. WITH L-LYSINE (1:1)
Systematic Name English
Code System Code Type Description
CAS
78000-32-5
Created by admin on Mon Mar 31 21:04:34 GMT 2025 , Edited by admin on Mon Mar 31 21:04:34 GMT 2025
PRIMARY
ECHA (EC/EINECS)
278-812-1
Created by admin on Mon Mar 31 21:04:34 GMT 2025 , Edited by admin on Mon Mar 31 21:04:34 GMT 2025
PRIMARY
FDA UNII
4TJZ858QD3
Created by admin on Mon Mar 31 21:04:34 GMT 2025 , Edited by admin on Mon Mar 31 21:04:34 GMT 2025
PRIMARY
PUBCHEM
14406341
Created by admin on Mon Mar 31 21:04:34 GMT 2025 , Edited by admin on Mon Mar 31 21:04:34 GMT 2025
PRIMARY
EPA CompTox
DTXSID90228655
Created by admin on Mon Mar 31 21:04:34 GMT 2025 , Edited by admin on Mon Mar 31 21:04:34 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
PARENT -> SALT/SOLVATE