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Details

Stereochemistry ABSOLUTE
Molecular Formula C13H14N4O4
Molecular Weight 290.2747
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of NITD-008

SMILES

NC1=C2C=CN([C@@H]3O[C@H](CO)[C@@H](O)[C@]3(O)C#C)C2=NC=N1

InChI

InChIKey=NKRAIOQPSBRMOV-NRMKKVEVSA-N
InChI=1S/C13H14N4O4/c1-2-13(20)9(19)8(5-18)21-12(13)17-4-3-7-10(14)15-6-16-11(7)17/h1,3-4,6,8-9,12,18-20H,5H2,(H2,14,15,16)/t8-,9-,12-,13-/m1/s1

HIDE SMILES / InChI

Molecular Formula C13H14N4O4
Molecular Weight 290.2747
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
0.31 µM [IC50]
Substance Class Chemical
Created
by admin
on Sat Dec 16 15:40:05 GMT 2023
Edited
by admin
on Sat Dec 16 15:40:05 GMT 2023
Record UNII
LKI7T3WQ2E
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NITD-008
Code English
7-(2-C-ETHYNYL-.BETA.-D-RIBOFURANOSYL)-7H-PYRROLO(2,3-D)PYRIMIDIN-4-AMINE
Systematic Name English
7H-PYRROLO(2,3-D)PYRIMIDIN-4-AMINE, 7-(2-C-ETHYNYL-.BETA.-D-RIBOFURANOSYL)-
Systematic Name English
7-DEAZA-2'-C-ACETYLENE-ADENOSINE
Common Name English
NITD008
Code English
Code System Code Type Description
PUBCHEM
44633776
Created by admin on Sat Dec 16 15:40:05 GMT 2023 , Edited by admin on Sat Dec 16 15:40:05 GMT 2023
PRIMARY
EPA CompTox
DTXSID701159354
Created by admin on Sat Dec 16 15:40:05 GMT 2023 , Edited by admin on Sat Dec 16 15:40:05 GMT 2023
PRIMARY
WIKIPEDIA
NITD008
Created by admin on Sat Dec 16 15:40:05 GMT 2023 , Edited by admin on Sat Dec 16 15:40:05 GMT 2023
PRIMARY
FDA UNII
LKI7T3WQ2E
Created by admin on Sat Dec 16 15:40:05 GMT 2023 , Edited by admin on Sat Dec 16 15:40:05 GMT 2023
PRIMARY
CAS
1044589-82-3
Created by admin on Sat Dec 16 15:40:05 GMT 2023 , Edited by admin on Sat Dec 16 15:40:05 GMT 2023
PRIMARY
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