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TYU

Summary
Name:TETRAHYDROURIDINE
Synonyms:1-(3,4-DIHYDROXY-5-HYDROXYMETHYL-TETRAHYDRO-FURAN-2-YL)-4- HYDROXY-TETRAHYDRO-PYRIMIDIN-2-ONE
Formula:C9 H16 N2 O6
Formal charge:0
Formula weight:248.233 Da
Component type:RNA LINKING

Chemical Identifiers

ProgramVersionName
ACDLabs10.04(4R)-4-hydroxy-1-beta-D-ribofuranosyltetrahydropyrimidin-2(1H)-one
OpenEye OEToolkits1.5.0(4R)-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4-hydroxy-1,3-diazinan-2-one

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=C1N(CCC(O)N1)C2OC(C(O)C2O)CO
SMILES_CANONICALCACTVS3.341OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N2CC[C@@H](O)NC2=O
SMILESCACTVS3.341OC[CH]1O[CH]([CH](O)[CH]1O)N2CC[CH](O)NC2=O
SMILES_CANONICALOpenEye OEToolkits1.5.0C1CN(C(=O)N[C@@H]1O)[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O
SMILESOpenEye OEToolkits1.5.0C1CN(C(=O)NC1O)C2C(C(C(O2)CO)O)O
InChIInChI1.03InChI=1S/C9H16N2O6/c12-3-4-6(14)7(15)8(17-4)11-2-1-5(13)10-9(11)16/h4-8,12-15H,1-3H2,(H,10,16)/t4-,5-,6-,7-,8-/m1/s1
InChIKeyInChI1.03UCKYOOZPSJFJIZ-FMDGEEDCSA-N

222624

数据于2024-07-17公开中

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