UMP

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Summary

Name:2'-DEOXYURIDINE 5'-MONOPHOSPHATE
Synonyms:DUMP
Formula:C9 H13 N2 O8 P
Formal charge:0
Molecular weight:308.182 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.012'-deoxy-5'-uridylic acid
OpenEye OEToolkits1.7.6[(2R,3S,5R)-5-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-3-oxidanyl-oxolan-2-yl]methyl dihydrogen phosphate

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=P(O)(O)OCC2OC(N1C(=O)NC(=O)C=C1)CC2O
InChIInChI1.03InChI=1S/C9H13N2O8P/c12-5-3-8(11-2-1-7(13)10-9(11)14)19-6(5)4-18-20(15,16)17/h1-2,5-6,8,12H,3-4H2,(H,10,13,14)(H2,15,16,17)/t5-,6+,8+/m0/s1
InChIKeyInChI1.03JSRLJPSBLDHEIO-SHYZEUOFSA-N
SMILES_CANONICALCACTVS3.370O[C@H]1C[C@@H](O[C@@H]1CO[P](O)(O)=O)N2C=CC(=O)NC2=O
SMILESCACTVS3.370O[CH]1C[CH](O[CH]1CO[P](O)(O)=O)N2C=CC(=O)NC2=O
SMILES_CANONICALOpenEye OEToolkits1.7.6C1[C@@H]([C@H](O[C@H]1N2C=CC(=O)NC2=O)COP(=O)(O)O)O
SMILESOpenEye OEToolkits1.7.6C1C(C(OC1N2C=CC(=O)NC2=O)COP(=O)(O)O)O
169117
PDB entries from 2020-09-23