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RFZ

Summary
Name:5,6-dichloro-1-beta-D-ribofuranosyl-1H-benzimidazole
Formula:C12 H12 Cl2 N2 O4
Formal charge:0
Formula weight:319.141 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.045,6-dichloro-1-beta-D-ribofuranosyl-1H-benzimidazole
OpenEye OEToolkits1.5.0(2R,3R,4S,5R)-2-(5,6-dichlorobenzimidazol-1-yl)-5-(hydroxymethyl)oxolane-3,4-diol

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04Clc2cc1ncn(c1cc2Cl)C3OC(C(O)C3O)CO
SMILES_CANONICALCACTVS3.341OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n2cnc3cc(Cl)c(Cl)cc23
SMILESCACTVS3.341OC[CH]1O[CH]([CH](O)[CH]1O)n2cnc3cc(Cl)c(Cl)cc23
SMILES_CANONICALOpenEye OEToolkits1.5.0c1c2c(cc(c1Cl)Cl)n(cn2)[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O
SMILESOpenEye OEToolkits1.5.0c1c2c(cc(c1Cl)Cl)n(cn2)C3C(C(C(O3)CO)O)O
InChIInChI1.03InChI=1S/C12H12Cl2N2O4/c13-5-1-7-8(2-6(5)14)16(4-15-7)12-11(19)10(18)9(3-17)20-12/h1-2,4,9-12,17-19H,3H2/t9-,10-,11-,12-/m1/s1
InChIKeyInChI1.03XHSQDZXAVJRBMX-DDHJBXDOSA-N

218500

PDB entries from 2024-04-17

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