Drug Information

Drug General Information
Drug ID
D05OUP
Former ID
DNC006838
Drug Name
1-propyl-5'-O-tritylinosine
Drug Type
Small molecular drug
Indication Discovery agent Investigative [528407]
Structure
Download
2D MOL

3D MOL
Formula
C32H32N4O5
Canonical SMILES
CCCN1C=NC2=C(C1=O)N=CN2C3C(C(C(O3)COC(C4=CC=CC=C4)(C5=C<br />C=CC=C5)C6=CC=CC=C6)O)O
InChI
1S/C32H32N4O5/c1-2-18-35-20-34-29-26(30(35)39)33-21-36(29)31-28(38)27(37)25(41-31)19-40-32(22-12-6-3-7-13-22,23-14-8-4-9-15-23)24-16-10-5-11-17-24/h3-17,20-21,25,27-28,31,37-38H,2,18-19H2,1H3/t25-,27-,28-,31-/m1/s1
InChIKey
GTLQVJJXEZWWMS-QWOIFIOOSA-N
PubChem Compound ID
16082758
Target and Pathway
Target(s) Thymidine phosphorylase Target Info Inhibitor [528407]
BioCyc Pathway Pyrimidine deoxyribonucleosides degradation
KEGG Pathway Pyrimidine metabolism
Drug metabolism - other enzymes
Metabolic pathways
Bladder cancer
NetPath Pathway TSH Signaling Pathway
PathWhiz Pathway Pyrimidine Metabolism
WikiPathways Bladder Cancer
Metabolism of nucleotides
Fluoropyrimidine Activity
References
Ref 528407J Med Chem. 2006 Sep 7;49(18):5562-70.5'-O-tritylinosine and analogues as allosteric inhibitors of human thymidine phosphorylase.
Ref 528407J Med Chem. 2006 Sep 7;49(18):5562-70.5'-O-tritylinosine and analogues as allosteric inhibitors of human thymidine phosphorylase.

If You Find Any Error in Data or Bug in Web Service, Please Kindly Report It to Dr. Zhou and Dr. Zhang.