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

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 Sat Dec 16 01:55:40 UTC 2023
Edited
by admin
on Sat Dec 16 01:55:40 UTC 2023
Record UNII
4TJZ858QD3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
LYSINE KETOISOCAPROATE
Common Name English
KETOLEUCINE LYSINE SALT
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 Sat Dec 16 01:55:41 UTC 2023 , Edited by admin on Sat Dec 16 01:55:41 UTC 2023
PRIMARY
ECHA (EC/EINECS)
278-812-1
Created by admin on Sat Dec 16 01:55:41 UTC 2023 , Edited by admin on Sat Dec 16 01:55:41 UTC 2023
PRIMARY
FDA UNII
4TJZ858QD3
Created by admin on Sat Dec 16 01:55:41 UTC 2023 , Edited by admin on Sat Dec 16 01:55:41 UTC 2023
PRIMARY
PUBCHEM
14406341
Created by admin on Sat Dec 16 01:55:41 UTC 2023 , Edited by admin on Sat Dec 16 01:55:41 UTC 2023
PRIMARY
EPA CompTox
DTXSID90228655
Created by admin on Sat Dec 16 01:55:41 UTC 2023 , Edited by admin on Sat Dec 16 01:55:41 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
PARENT -> SALT/SOLVATE