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

Details

Stereochemistry RACEMIC
Molecular Formula C7H9N3O5
Molecular Weight 215.1635
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of .ALPHA.-HYDROXY-2-METHYL-5-NITRO-1H-IMIDAZOLE-1-PROPANOIC ACID

SMILES

CC1=NC=C(N1CC(O)C(O)=O)[N+]([O-])=O

InChI

InChIKey=DAFCQBZGXBXLSX-UHFFFAOYSA-N
InChI=1S/C7H9N3O5/c1-4-8-2-6(10(14)15)9(4)3-5(11)7(12)13/h2,5,11H,3H2,1H3,(H,12,13)

HIDE SMILES / InChI

Molecular Formula C7H9N3O5
Molecular Weight 215.1635
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 15:08:45 UTC 2023
Edited
by admin
on Sat Dec 16 15:08:45 UTC 2023
Record UNII
PYU1I3I64V
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
.ALPHA.-HYDROXY-2-METHYL-5-NITRO-1H-IMIDAZOLE-1-PROPANOIC ACID
Systematic Name English
1H-IMIDAZOLE-1-PROPANOIC ACID, .ALPHA.-HYDROXY-2-METHYL-5-NITRO-
Systematic Name English
ORNIDAZOLE METABOLITE M7
Common Name English
Code System Code Type Description
PUBCHEM
145722626
Created by admin on Sat Dec 16 15:08:45 UTC 2023 , Edited by admin on Sat Dec 16 15:08:45 UTC 2023
PRIMARY
FDA UNII
PYU1I3I64V
Created by admin on Sat Dec 16 15:08:45 UTC 2023 , Edited by admin on Sat Dec 16 15:08:45 UTC 2023
PRIMARY
CAS
1452323-31-7
Created by admin on Sat Dec 16 15:08:45 UTC 2023 , Edited by admin on Sat Dec 16 15:08:45 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE
URINE