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

Details

Stereochemistry ACHIRAL
Molecular Formula C17H13N3O7
Molecular Weight 371.301
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of PYR-41

SMILES

CCOC(=O)C1=CC=C(C=C1)N2NC(=O)\C(=C\C3=CC=C(O3)[N+]([O-])=O)C2=O

InChI

InChIKey=ARGIPZKQJGFSGQ-LCYFTJDESA-N
InChI=1S/C17H13N3O7/c1-2-26-17(23)10-3-5-11(6-4-10)19-16(22)13(15(21)18-19)9-12-7-8-14(27-12)20(24)25/h3-9H,2H2,1H3,(H,18,21)/b13-9-

HIDE SMILES / InChI

Molecular Formula C17H13N3O7
Molecular Weight 371.301
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
Target ID: Q02053
Gene ID: 22201.0
Gene Symbol: Uba1
Target Organism: Mus musculus (Mouse)
Substance Class Chemical
Created
by admin
on Sat Dec 16 17:34:16 GMT 2023
Edited
by admin
on Sat Dec 16 17:34:16 GMT 2023
Record UNII
HT54RAN9JZ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PYR-41
Common Name English
NSC-746131
Code English
BENZOIC ACID, 4-(4-((5-NITRO-2-FURANYL)METHYLENE)-3,5-DIOXO-1-PYRAZOLIDINYL)-, ETHYL ESTER
Systematic Name English
Ethyl 4-(4-((5-nitrofuran-2-yl)methylene)-3,5-dioxopyrazolidin-1-yl)benzoate
Systematic Name English
Code System Code Type Description
CAS
418805-02-4
Created by admin on Sat Dec 16 17:34:16 GMT 2023 , Edited by admin on Sat Dec 16 17:34:16 GMT 2023
PRIMARY
FDA UNII
HT54RAN9JZ
Created by admin on Sat Dec 16 17:34:16 GMT 2023 , Edited by admin on Sat Dec 16 17:34:16 GMT 2023
PRIMARY
NSC
746131
Created by admin on Sat Dec 16 17:34:16 GMT 2023 , Edited by admin on Sat Dec 16 17:34:16 GMT 2023
PRIMARY
WIKIPEDIA
PYR-41
Created by admin on Sat Dec 16 17:34:16 GMT 2023 , Edited by admin on Sat Dec 16 17:34:16 GMT 2023
PRIMARY
PUBCHEM
5335621
Created by admin on Sat Dec 16 17:34:16 GMT 2023 , Edited by admin on Sat Dec 16 17:34:16 GMT 2023
PRIMARY
EPA CompTox
DTXSID30416554
Created by admin on Sat Dec 16 17:34:16 GMT 2023 , Edited by admin on Sat Dec 16 17:34:16 GMT 2023
PRIMARY