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Concept information

Preferred term

6-/{[(4r,5r)-4-(hydroxymethyl)thymin-5-yl]methyl/}thymine  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

charge

  • 0

formula

  • C12H16N4O5

has_functional_parent

inchi

  • InChI=1S/C12H16N4O5/c1-5-6(13-10(20)15-8(5)18)3-12(2)7(4-17)14-11(21)16-9(12)19/h7,17H,3-4H2,1-2H3,(H2,13,15,18,20)(H2,14,16,19,21)/t7-,12+/m0/s1

inchikey

  • KBBKHMIEEMSXSM-JVXZTZIISA-N

mass

  • 296.27920

monoisotopicmass

  • 296.11207

smiles

  • Cc1c(C[C@]2(C)[C@H](CO)NC(=O)NC2=O)[nH]c(=O)[nH]c1=O

subset

  • 3_STAR

synonym EXACT

  • 6-{[(4R,5R)-4-(hydroxymethyl)-5-methyl-2,6-dioxohexahydropyrimidin-5-yl]methyl}-5-methylpyrimidine-2,4(1H,3H)-dione

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:45366

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