Drug Information

Drug General Information
Drug ID
D0S2FW
Former ID
DNC000805
Drug Name
Iodotubercidin
Drug Type
Small molecular drug
Indication Discovery agent Investigative [531635]
Structure
Download
2D MOL

3D MOL
Formula
C11H13IN4O4
Canonical SMILES
C1=C(C2=C(N1C3C(C(C(O3)CO)O)O)N=CN=C2N)I
InChI
1S/C11H13IN4O4/c12-4-1-16(10-6(4)9(13)14-3-15-10)11-8(19)7(18)5(2-17)20-11/h1,3,5,7-8,11,17-19H,2H2,(H2,13,14,15)/t5-,7-,8-,11?/m1/s1
InChIKey
WHSIXKUPQCKWBY-YNJARDAQSA-N
CAS Number
CAS 24386-93-4
PubChem Compound ID
46875276
PubChem Substance ID
123075669, 139859511, 160847813, 237567392, 247919176
Target and Pathway
Target(s) Adenosine kinase Target Info Inhibitor [531635]
BioCyc Pathway Superpathway of purine nucleotide salvage
Adenine and adenosine salvage II
KEGG Pathway Purine metabolism
Metabolic pathways
Reactome Purine salvage
WikiPathways Metabolism of nucleotides
References
Ref 531635Therapeutic target database update 2012: a resource for facilitating target-oriented drug discovery. Nucleic Acids Res. 2012 Jan;40(Database issue):D1128-36.
Ref 531635Therapeutic target database update 2012: a resource for facilitating target-oriented drug discovery. Nucleic Acids Res. 2012 Jan;40(Database issue):D1128-36.

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