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3DG

Summary
Name:9-(3-DEOXY-BETA-D-RIBOFURANOSYL)GUANINE
Synonyms:3-DEOXYGUANOSINE
Formula:C10 H13 N5 O4
Formal charge:0
Formula weight:267.241 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.043'-deoxyguanosine
OpenEye OEToolkits1.5.02-amino-9-[(2R,3R,5S)-3-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-1H-purin-6-one

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=C1c2ncn(c2N=C(N)N1)C3OC(CC3O)CO
SMILES_CANONICALCACTVS3.341NC1=Nc2n(cnc2C(=O)N1)[C@@H]3O[C@H](CO)C[C@H]3O
SMILESCACTVS3.341NC1=Nc2n(cnc2C(=O)N1)[CH]3O[CH](CO)C[CH]3O
SMILES_CANONICALOpenEye OEToolkits1.5.0c1nc2c(n1[C@H]3[C@@H](C[C@H](O3)CO)O)N=C(NC2=O)N
SMILESOpenEye OEToolkits1.5.0c1nc2c(n1C3C(CC(O3)CO)O)N=C(NC2=O)N
InChIInChI1.03InChI=1S/C10H13N5O4/c11-10-13-7-6(8(18)14-10)12-3-15(7)9-5(17)1-4(2-16)19-9/h3-5,9,16-17H,1-2H2,(H3,11,13,14,18)/t4-,5+,9+/m0/s1
InChIKeyInChI1.03OROIAVZITJBGSM-OBXARNEKSA-N

223790

PDB entries from 2024-08-14

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