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YC6

Summary
Name:1-(2-deoxy-alpha-D-erythro-pentofuranosyl)-5-methylpyrimidine-2,4(1H,3H)-dione
Formula:C10 H12 N2 O6
Formal charge:0
Formula weight:256.212 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs12.011-(2-deoxy-alpha-D-erythro-pentofuranosyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbaldehyde
OpenEye OEToolkits2.0.71-[(2~{S},4~{S},5~{R})-5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-2,4-bis(oxidanylidene)pyrimidine-5-carbaldehyde

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=CC1=CN(C(=O)NC1=O)C1CC(O)C(CO)O1
InChIInChI1.06InChI=1S/C10H12N2O6/c13-3-5-2-12(10(17)11-9(5)16)8-1-6(15)7(4-14)18-8/h2-3,6-8,14-15H,1,4H2,(H,11,16,17)/t6-,7+,8-/m0/s1
InChIKeyInChI1.06MVORBLZUGBSUNB-RNJXMRFFSA-N
SMILES_CANONICALCACTVS3.385OC[C@H]1O[C@@H](C[C@@H]1O)N2C=C(C=O)C(=O)NC2=O
SMILESCACTVS3.385OC[CH]1O[CH](C[CH]1O)N2C=C(C=O)C(=O)NC2=O
SMILES_CANONICALOpenEye OEToolkits2.0.7C1[C@@H]([C@H](O[C@@H]1N2C=C(C(=O)NC2=O)C=O)CO)O
SMILESOpenEye OEToolkits2.0.7C1C(C(OC1N2C=C(C(=O)NC2=O)C=O)CO)O

247536

PDB entries from 2026-01-14

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