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Details

Stereochemistry ABSOLUTE
Molecular Formula C12H13N5O4
Molecular Weight 291.2632
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of GS-441524

SMILES

c1cc([C@@]2(C#N)[C@@]([H])([C@@]([H])([C@@]([H])(CO)O2)O)O)n3c1c(N)ncn3

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 291.2632
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 Jun 26 15:27:59 UTC 2021
Edited
by admin
on Sat Jun 26 15:27:59 UTC 2021
Record UNII
1BQK176DT6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
GS-441524
Common Name 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
Common Name English
Code System Code Type Description
PUBCHEM
44468216
Created by admin on Sat Jun 26 15:27:59 UTC 2021 , Edited by admin on Sat Jun 26 15:27:59 UTC 2021
PRIMARY
FDA UNII
1BQK176DT6
Created by admin on Sat Jun 26 15:27:59 UTC 2021 , Edited by admin on Sat Jun 26 15:27:59 UTC 2021
PRIMARY
DRUG BANK
DB15686
Created by admin on Sat Jun 26 15:27:59 UTC 2021 , Edited by admin on Sat Jun 26 15:27:59 UTC 2021
PRIMARY
CAS
1191237-69-0
Created by admin on Sat Jun 26 15:27:59 UTC 2021 , Edited by admin on Sat Jun 26 15:27:59 UTC 2021
PRIMARY
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