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IRN

Summary
Name:1-(5-O-phosphono-beta-D-ribofuranosyl)-1H-imidazole
Formula:C8 H13 N2 O7 P
Formal charge:0
Formula weight:280.172 Da
Component type:RNA linking

Chemical Identifiers

ProgramVersionName
ACDLabs10.041-(5-O-phosphono-beta-D-ribofuranosyl)-1H-imidazole
OpenEye OEToolkits1.5.0[(2R,3S,4R,5R)-3,4-dihydroxy-5-imidazol-1-yl-oxolan-2-yl]methyl dihydrogen phosphate

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=P(O)(O)OCC2OC(n1cncc1)C(O)C2O
SMILES_CANONICALCACTVS3.341O[C@H]1[C@@H](O)[C@@H](O[C@@H]1CO[P](O)(O)=O)n2ccnc2
SMILESCACTVS3.341O[CH]1[CH](O)[CH](O[CH]1CO[P](O)(O)=O)n2ccnc2
SMILES_CANONICALOpenEye OEToolkits1.5.0c1cn(cn1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)O)O)O
SMILESOpenEye OEToolkits1.5.0c1cn(cn1)C2C(C(C(O2)COP(=O)(O)O)O)O
InChIInChI1.03InChI=1S/C8H13N2O7P/c11-6-5(3-16-18(13,14)15)17-8(7(6)12)10-2-1-9-4-10/h1-2,4-8,11-12H,3H2,(H2,13,14,15)/t5-,6-,7-,8-/m1/s1
InChIKeyInChI1.03YEBULYOZZUNFGU-WCTZXXKLSA-N

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건을2024-06-26부터공개중

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