L2B

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Summary

Name:3'-DEOXYURIDINE-5'-MONOPHOSPHATE
Synonyms:[(2~{S},4~{R},5~{R})-5-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-4-oxidanyl-oxolan-2-yl]methyl dihydrogen phosphate
Formula:C9 H13 N2 O8 P
Formal charge:0
Molecular weight:308.182 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.7[(2~{S},4~{R},5~{R})-5-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-4-oxidanyl-oxolan-2-yl]methyl dihydrogen phosphate

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C9H13N2O8P/c12-6-3-5(4-18-20(15,16)17)19-8(6)11-2-1-7(13)10-9(11)14/h1-2,5-6,8,12H,3-4H2,(H,10,13,14)(H2,15,16,17)/t5-,6+,8+/m0/s1
InChIKeyInChI1.03SEOHEWZQAGEAGZ-SHYZEUOFSA-N
SMILES_CANONICALCACTVS3.385O[C@@H]1C[C@@H](CO[P](O)(O)=O)O[C@H]1N2C=CC(=O)NC2=O
SMILESCACTVS3.385O[CH]1C[CH](CO[P](O)(O)=O)O[CH]1N2C=CC(=O)NC2=O
SMILES_CANONICALOpenEye OEToolkits2.0.7C1[C@H](O[C@H]([C@@H]1O)N2C=CC(=O)NC2=O)COP(=O)(O)O
SMILESOpenEye OEToolkits2.0.7C1C(OC(C1O)N2C=CC(=O)NC2=O)COP(=O)(O)O
171916
PDB entries from 2020-12-02