Chemical Component Summary

Name1-(2-deoxy-2-methyl-beta-D-arabinofuranosyl)-5-ethynylpyrimidine-2,4(1H,3H)-dione
Synonyms(2'S)-2'-DEOXY-2'-METHYL-5-ETHYNYLURIDINE
Identifiers5-ethynyl-1-[(2R,3S,4S,5R)-5-(hydroxymethyl)-3-methyl-4-oxidanyl-oxolan-2-yl]pyrimidine-2,4-dione
FormulaC12 H14 N2 O5
Molecular Weight266.25
TypeNON-POLYMER
Isomeric SMILESC[C@H]1[C@@H]([C@H](O[C@H]1N2C=C(C(=O)NC2=O)C#C)CO)O
InChIInChI=1S/C12H14N2O5/c1-3-7-4-14(12(18)13-10(7)17)11-6(2)9(16)8(5-15)19-11/h1,4,6,8-9,11,15-16H,5H2,2H3,(H,13,17,18)/t6-,8+,9-,11+/m0/s1
InChIKeyHBALXYGFMJGYHQ-GTQWGBSQSA-N

Chemical Details

Formal Charge0
Atom Count33
Chiral Atom Count4
Bond Count34
Aromatic Bond Count0

Related Resource References

Resource NameReference
PubChem 10515865