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THU

Summary
Name:TETRAHYDRODEOXYURIDINE
Formula:C9 H14 N2 O5
Formal charge:0
Formula weight:230.218 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.042'-deoxyuridine
OpenEye OEToolkits1.5.01-[(4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,3-diazinane-2,4-dione

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=C1N(CCC(=O)N1)C2OC(C(O)C2)CO
SMILES_CANONICALCACTVS3.341OC[C@H]1O[C@H](C[C@@H]1O)N2CCC(=O)NC2=O
SMILESCACTVS3.341OC[CH]1O[CH](C[CH]1O)N2CCC(=O)NC2=O
SMILES_CANONICALOpenEye OEToolkits1.5.0C1CN(C(=O)NC1=O)C2C[C@@H]([C@H](O2)CO)O
SMILESOpenEye OEToolkits1.5.0C1CN(C(=O)NC1=O)C2CC(C(O2)CO)O
InChIInChI1.03InChI=1S/C9H14N2O5/c12-4-6-5(13)3-8(16-6)11-2-1-7(14)10-9(11)15/h5-6,8,12-13H,1-4H2,(H,10,14,15)/t5-,6+,8?/m0/s1
InChIKeyInChI1.03XMJRLEURHMTTRX-FWHJPCMOSA-N

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PDB entries from 2024-07-17

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