Chemical Component Summary

Name2',3'-DEHYDRO-2',3'-DEOXY-THYMIDINE 5'-DIPHOSPHATE
Identifiers[(2S,5R)-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)-2,5-dihydrofuran-2-yl]methyl phosphono hydrogen phosphate
FormulaC10 H14 N2 O10 P2
Molecular Weight384.173
TypeNON-POLYMER
Isomeric SMILESCC1=CN(C(=O)NC1=O)[C@H]2C=C[C@H](O2)CO[P@](=O)(O)OP(=O)(O)O
InChIInChI=1S/C10H14N2O10P2/c1-6-4-12(10(14)11-9(6)13)8-3-2-7(21-8)5-20-24(18,19)22-23(15,16)17/h2-4,7-8H,5H2,1H3,(H,18,19)(H,11,13,14)(H2,15,16,17)/t7-,8+/m0/s1
InChIKeyLXCAIISEDMYORY-JGVFFNPUSA-N

Chemical Details

Formal Charge0
Atom Count38
Chiral Atom Count3
Bond Count39
Aromatic Bond Count6

Drug Info: DrugBank

DrugBank IDDB02569 
Name2',3'-Dehydro-2',3'-Deoxy-Thymidine 5'-Diphosphate
Groups experimental
Synonyms2',3'-Dehydro-2',3'-Deoxy-Thymidine 5'-Diphosphate

Drug Targets

NameTarget SequencePharmacological ActionActions
Nucleoside diphosphate kinase AMANCERTFIAIKPDGVQRGLVGEIIKRFEQKGFRLVGLKFMQASEDLLKE...unknown
Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682

Related Resource References

Resource NameReference
PubChem 461279
ChEMBL CHEMBL405730