PRH

6-HYDROXY-1,6-DIHYDRO PURINE NUCLEOSIDE

Created: 1999-07-08
Last modified:  2011-06-04

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Chemical Details

Formal Charge1
Atom Count34
Chiral Atom Count5
Bond Count36
Aromatic Bond Count5
2D diagram of PRH
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Chemical Component Summary

Name6-HYDROXY-1,6-DIHYDRO PURINE NUCLEOSIDE
Systematic Name (OpenEye OEToolkits)(2R,3R,4S,5R)-2-[(6S)-6-hydroxy-1,6-dihydropurin-7-ium-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
FormulaC10 H15 N4 O5
Molecular Weight271.25
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs10.04OC1c2[nH+]cn(c2N=CN1)C3OC(C(O)C3O)CO
SMILESCACTVS3.341OC[CH]1O[CH]([CH](O)[CH]1O)n2c[nH+]c3[CH](O)NC=Nc23
SMILESOpenEye OEToolkits1.5.0c1[nH+]c2c(n1C3C(C(C(O3)CO)O)O)N=CNC2O
Canonical SMILESCACTVS3.341 OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n2c[nH+]c3[C@H](O)NC=Nc23
Canonical SMILESOpenEye OEToolkits1.5.0 c1[nH+]c2c(n1[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O)N=CN[C@H]2O
InChIInChI1.03 InChI=1S/C10H14N4O5/c15-1-4-6(16)7(17)10(19-4)14-3-13-5-8(14)11-2-12-9(5)18/h2-4,6-7,9-10,15-18H,1H2,(H,11,12)/p+1/t4-,6-,7-,9+,10-/m1/s1
InChIKeyInChI1.03 WGRXVKRHIMUTPD-YOHZANMFSA-O

Drug Info: DrugBank

DrugBank IDDB03015 
Name6-hydroxy-1,6-dihydro purine nucleoside
Groups experimental
Synonyms6-hydroxy-1,6-dihydro purine nucleoside

Drug Targets

NameTarget SequencePharmacological ActionActions
Adenosine deaminaseMAQTPAFDKPKVELHVHLDGSIKPETILYYGRRRGIALPANTAEGLLNVI...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 5289205