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Concept information

organoiodine compound > 3-iodo-4-aminobenzyl-5'-n-methylcarboxamidoadenosine
organooxygen compound > carboxamide > monocarboxylic acid amide > 3-iodo-4-aminobenzyl-5'-n-methylcarboxamidoadenosine
... > organic aromatic compound > heteroarene > imidazopyrimidine > purines > purine nucleoside > purine ribonucleoside > adenosines > 3-iodo-4-aminobenzyl-5'-n-methylcarboxamidoadenosine
... > organic heterocyclic compound > heteroarene > imidazopyrimidine > purines > purine nucleoside > purine ribonucleoside > adenosines > 3-iodo-4-aminobenzyl-5'-n-methylcarboxamidoadenosine

Preferred term

3-iodo-4-aminobenzyl-5'-n-methylcarboxamidoadenosine  

Type

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

charge

  • 0

formula

  • C18H20IN7O4

has_functional_parent

inchi

  • InChI=1S/C18H20IN7O4/c1-21-17(29)14-12(27)13(28)18(30-14)26-7-25-11-15(23-6-24-16(11)26)22-5-8-2-3-10(20)9(19)4-8/h2-4,6-7,12-14,18,27-28H,5,20H2,1H3,(H,21,29)(H,22,23,24)/t12-,13+,14-,18+/m0/s1

inchikey

  • LOGOEBMHHXYBID-MOROJQBDSA-N

mass

  • 525.30040

monoisotopicmass

  • 525.06215

smiles

  • CNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCc3ccc(N)c(I)c3)ncnc12

subset

  • 3_STAR

synonym EXACT

  • (2S,3S,4R,5R)-5-{6-[(4-amino-3-iodobenzyl)amino]-9H-purin-9-yl}-3,4-dihydroxy-N-methyltetrahydrofuran-2-carboxamide

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:73285

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