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Details

Stereochemistry ACHIRAL
Molecular Formula C5H5NO3
Molecular Weight 127.0983
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-CARBOXY-5-METHYLISOXAZOLE

SMILES

Cc1cc(C(=O)O)no1

InChI

InChIKey=BNMPIJWVMVNSRD-UHFFFAOYSA-N
InChI=1S/C5H5NO3/c1-3-2-4(5(7)8)6-9-3/h2H,1H3,(H,7,8)

HIDE SMILES / InChI

Molecular Formula C5H5NO3
Molecular Weight 127.0983
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
0.00200000000000000004 nM [IC50]
90.7000000000000028 nM [IC50]
0.419999999999999984 nM [IC50]
252 nM [IC50]
271 nM [IC50]
Substance Class Chemical
Created
by admin
on Sat Jun 26 15:33:59 UTC 2021
Edited
by admin
on Sat Jun 26 15:33:59 UTC 2021
Record UNII
YZP807C30G
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-CARBOXY-5-METHYLISOXAZOLE
Systematic Name English
3-ISOXAZOLECARBOXYLIC ACID, 5-METHYL-
Systematic Name English
5-METHYL-3-ISOXAZOLECARBOXYLIC ACID
Systematic Name English
5-METHYL-1,2-OXAZOLE-3-CARBOXYLIC ACID
Systematic Name English
ISOX
Common Name English
Code System Code Type Description
ECHA (EC/EINECS)
222-289-4
Created by admin on Sat Jun 26 15:34:00 UTC 2021 , Edited by admin on Sat Jun 26 15:34:00 UTC 2021
PRIMARY
FDA UNII
YZP807C30G
Created by admin on Sat Jun 26 15:34:00 UTC 2021 , Edited by admin on Sat Jun 26 15:34:00 UTC 2021
PRIMARY
CAS
3405-77-4
Created by admin on Sat Jun 26 15:34:00 UTC 2021 , Edited by admin on Sat Jun 26 15:34:00 UTC 2021
PRIMARY
PUBCHEM
76947
Created by admin on Sat Jun 26 15:34:00 UTC 2021 , Edited by admin on Sat Jun 26 15:34:00 UTC 2021
PRIMARY
Related Record Type Details
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