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URD

Summary
Name:1-((2R,3R,4S,5R)-TETRAHYDRO-3,4-DIHYDROXY-5-(HYDROXYMETHYL)FURAN-2-YL)PYRIDINE-2,4(1H,3H)-DIONE
Synonyms:3-DEAZAURIDINE
Formula:C10 H13 N O6
Formal charge:0
Formula weight:243.213 Da
Component type:RNA LINKING

Chemical Identifiers

ProgramVersionName
ACDLabs10.041-beta-D-ribofuranosylpyridine-2,4(1H,3H)-dione
OpenEye OEToolkits1.5.01-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyridine-2,4-dione

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=C1C=CN(C(=O)C1)C2OC(C(O)C2O)CO
SMILES_CANONICALCACTVS3.341OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N2C=CC(=O)CC2=O
SMILESCACTVS3.341OC[CH]1O[CH]([CH](O)[CH]1O)N2C=CC(=O)CC2=O
SMILES_CANONICALOpenEye OEToolkits1.5.0C1C(=O)C=CN(C1=O)[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O
SMILESOpenEye OEToolkits1.5.0C1C(=O)C=CN(C1=O)C2C(C(C(O2)CO)O)O
InChIInChI1.03InChI=1S/C10H13NO6/c12-4-6-8(15)9(16)10(17-6)11-2-1-5(13)3-7(11)14/h1-2,6,8-10,12,15-16H,3-4H2/t6-,8-,9-,10-/m1/s1
InChIKeyInChI1.03WIRVQQCUKDPURA-PEBGCTIMSA-N

223532

PDB entries from 2024-08-07

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