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Details

Stereochemistry ABSOLUTE
Molecular Formula C6H9N3O2.C5H6O5
Molecular Weight 301.2527
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of HISTIDINE OXOGLURATE

SMILES

OC(=O)CCC(=O)C(O)=O.N[C@@H](CC1=CNC=N1)C(O)=O

InChI

InChIKey=NEZITABMBWLXRB-JEDNCBNOSA-N
InChI=1S/C6H9N3O2.C5H6O5/c7-5(6(10)11)1-4-2-8-3-9-4;6-3(5(9)10)1-2-4(7)8/h2-3,5H,1,7H2,(H,8,9)(H,10,11);1-2H2,(H,7,8)(H,9,10)/t5-;/m0./s1

HIDE SMILES / InChI

Molecular Formula C5H6O5
Molecular Weight 146.0981
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C6H9N3O2
Molecular Weight 155.1546
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 10:07:36 UTC 2023
Edited
by admin
on Sat Dec 16 10:07:36 UTC 2023
Record UNII
H25LX6BV3L
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
HISTIDINE OXOGLURATE
Common Name English
L-HISTIDINE, 2-OXOPENTANEDIOATE (1:1)
Systematic Name English
HISTIDINE .ALPHA.-KETOGLUTARATE
Systematic Name English
Code System Code Type Description
CAS
1185729-41-2
Created by admin on Sat Dec 16 10:07:36 UTC 2023 , Edited by admin on Sat Dec 16 10:07:36 UTC 2023
PRIMARY
PUBCHEM
46911993
Created by admin on Sat Dec 16 10:07:36 UTC 2023 , Edited by admin on Sat Dec 16 10:07:36 UTC 2023
PRIMARY
FDA UNII
H25LX6BV3L
Created by admin on Sat Dec 16 10:07:36 UTC 2023 , Edited by admin on Sat Dec 16 10:07:36 UTC 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY