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5HT

Summary
Name:5-HYDROXY-THYMIDINE
Formula:C10 H16 N2 O6
Formal charge:0
Formula weight:260.244 Da
Component type:DNA LINKING

Chemical Identifiers

ProgramVersionName
ACDLabs10.045-hydroxythymidine
OpenEye OEToolkits1.5.0(5R)-5-hydroxy-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methyl-1,3-diazinane-2,4-dione

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=C1N(CC(O)(C(=O)N1)C)C2OC(C(O)C2)CO
SMILES_CANONICALCACTVS3.341C[C@@]1(O)CN([C@H]2C[C@H](O)[C@@H](CO)O2)C(=O)NC1=O
SMILESCACTVS3.341C[C]1(O)CN([CH]2C[CH](O)[CH](CO)O2)C(=O)NC1=O
SMILES_CANONICALOpenEye OEToolkits1.5.0C[C@]1(CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)CO)O)O
SMILESOpenEye OEToolkits1.5.0CC1(CN(C(=O)NC1=O)C2CC(C(O2)CO)O)O
InChIInChI1.03InChI=1S/C10H16N2O6/c1-10(17)4-12(9(16)11-8(10)15)7-2-5(14)6(3-13)18-7/h5-7,13-14,17H,2-4H2,1H3,(H,11,15,16)/t5-,6+,7+,10+/m0/s1
InChIKeyInChI1.03MRODUHNLAXSPFV-MPXCPUAZSA-N

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PDB entries from 2024-09-11

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