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

Details

Stereochemistry ABSOLUTE
Molecular Formula C12H13N5O4
Molecular Weight 291.2627
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of GS-441524

SMILES

NC1=NC=NN2C1=CC=C2[C@@]3(O[C@H](CO)[C@@H](O)[C@H]3O)C#N

InChI

InChIKey=BRDWIEOJOWJCLU-LTGWCKQJSA-N
InChI=1S/C12H13N5O4/c13-4-12(10(20)9(19)7(3-18)21-12)8-2-1-6-11(14)15-5-16-17(6)8/h1-2,5,7,9-10,18-20H,3H2,(H2,14,15,16)/t7-,9-,10-,12+/m1/s1

HIDE SMILES / InChI

Molecular Formula C12H13N5O4
Molecular Weight 291.2627
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 Sat Dec 16 16:03:25 GMT 2023
Edited
by admin
on Sat Dec 16 16:03:25 GMT 2023
Record UNII
1BQK176DT6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
GS-441524
Code English
2-C-(4-AMINOPYRROLO(2,1-F)(1,2,4)TRIAZIN-7-YL)-2,5-ANHYDRO-D-ALTRONONITRILE
Systematic Name English
D-ALTRONONITRILE, 2-C-(4-AMINOPYRROLO(2,1-F)(1,2,4)TRIAZIN-7-YL)-2,5-ANHYDRO-
Systematic Name English
GS441524
Code English
Code System Code Type Description
PUBCHEM
44468216
Created by admin on Sat Dec 16 16:03:26 GMT 2023 , Edited by admin on Sat Dec 16 16:03:26 GMT 2023
PRIMARY
FDA UNII
1BQK176DT6
Created by admin on Sat Dec 16 16:03:26 GMT 2023 , Edited by admin on Sat Dec 16 16:03:26 GMT 2023
PRIMARY
EPA CompTox
DTXSID201028047
Created by admin on Sat Dec 16 16:03:26 GMT 2023 , Edited by admin on Sat Dec 16 16:03:26 GMT 2023
PRIMARY
DRUG BANK
DB15686
Created by admin on Sat Dec 16 16:03:26 GMT 2023 , Edited by admin on Sat Dec 16 16:03:26 GMT 2023
PRIMARY
CAS
1191237-69-0
Created by admin on Sat Dec 16 16:03:26 GMT 2023 , Edited by admin on Sat Dec 16 16:03:26 GMT 2023
PRIMARY
WIKIPEDIA
GS-441524
Created by admin on Sat Dec 16 16:03:26 GMT 2023 , Edited by admin on Sat Dec 16 16:03:26 GMT 2023
PRIMARY
CHEBI
147281
Created by admin on Sat Dec 16 16:03:26 GMT 2023 , Edited by admin on Sat Dec 16 16:03:26 GMT 2023
PRIMARY
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