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Concept information

Preferred term

GS 443902  

Type

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

charge

  • 0

formula

  • C12H16N5O13P3

has_functional_parent

inchi

  • InChI=1S/C12H16N5O13P3/c13-4-12(8-2-1-6-11(14)15-5-16-17(6)8)10(19)9(18)7(28-12)3-27-32(23,24)30-33(25,26)29-31(20,21)22/h1-2,5,7,9-10,18-19H,3H2,(H,23,24)(H,25,26)(H2,14,15,16)(H2,20,21,22)/t7-,9-,10-,12+/m1/s1

inchikey

  • DFVPCNAMNAPBCX-LTGWCKQJSA-N

mass

  • 531.203

monoisotopicmass

  • 530.99575

smiles

  • [C@]1(O[C@@H]([C@H]([C@H]1O)O)COP(OP(OP(O)(=O)O)(=O)O)(=O)O)(C#N)C=2N3N=CN=C(C3=CC2)N

subset

  • 3_STAR

synonym EXACT

  • ((2R,3S,4R,5R)-5-(4-Aminopyrrolo[2,1-f][1,2,4]triazin-7-yl)-5-cyano-3,4-dihydroxytetrahydrofuran-2-yl)methyl tetrahydrogen triphosphate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:150869

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