U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS
This repository is under review for potential modification in compliance with Administration directives.

Details

Stereochemistry ABSOLUTE
Molecular Formula C16H21N5O4
Molecular Weight 347.369
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of GP-531

SMILES

NC(=O)C1=C(N)N(C=N1)[C@@H]2O[C@H](CNCC3=CC=CC=C3)[C@@H](O)[C@H]2O

InChI

InChIKey=LECUGLHMNZTZQB-XNIJJKJLSA-N
InChI=1S/C16H21N5O4/c17-14-11(15(18)24)20-8-21(14)16-13(23)12(22)10(25-16)7-19-6-9-4-2-1-3-5-9/h1-5,8,10,12-13,16,19,22-23H,6-7,17H2,(H2,18,24)/t10-,12-,13-,16-/m1/s1

HIDE SMILES / InChI

Molecular Formula C16H21N5O4
Molecular Weight 347.369
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 21:49:05 GMT 2025
Edited
by admin
on Tue Apr 01 21:49:05 GMT 2025
Record UNII
UK37HM0CDG
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1H-IMIDAZOLE-4-CARBOXAMIDE, 5-AMINO-1-(5-DEOXY-5-((PHENYLMETHYL)AMINO)-.BETA.-D-RIBOFURANOSYL)-
Preferred Name English
GP-531
Code English
5-AMINO-1-(5-DEOXY-5-((PHENYLMETHYL)AMINO)-.BETA.-D-RIBOFURANOSYL)-1H-IMIDAZOLE-4-CARBOXAMIDE
Systematic Name English
Code System Code Type Description
PUBCHEM
164444
Created by admin on Tue Apr 01 21:49:05 GMT 2025 , Edited by admin on Tue Apr 01 21:49:05 GMT 2025
PRIMARY
EPA CompTox
DTXSID90931415
Created by admin on Tue Apr 01 21:49:05 GMT 2025 , Edited by admin on Tue Apr 01 21:49:05 GMT 2025
PRIMARY
CAS
142344-87-4
Created by admin on Tue Apr 01 21:49:05 GMT 2025 , Edited by admin on Tue Apr 01 21:49:05 GMT 2025
PRIMARY
FDA UNII
UK37HM0CDG
Created by admin on Tue Apr 01 21:49:05 GMT 2025 , Edited by admin on Tue Apr 01 21:49:05 GMT 2025
PRIMARY
Related Record Type Details
TARGET -> AGONIST
Ki
SALT/SOLVATE -> PARENT