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Concept information

Preferred term

2-[(2s,5s,6r)-6-(hydroxymethyl)-5-[[(3-methoxyanilino)-oxomethyl]amino]-2-oxanyl]-n-(4-pyrimidinylmethyl)acetamide  

Type

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

Broader concept

charge

  • 0

formula

  • C21H27N5O5

inchi

  • InChI=1S/C21H27N5O5/c1-30-16-4-2-3-14(9-16)25-21(29)26-18-6-5-17(31-19(18)12-27)10-20(28)23-11-15-7-8-22-13-24-15/h2-4,7-9,13,17-19,27H,5-6,10-12H2,1H3,(H,23,28)(H2,25,26,29)/t17-,18-,19-/m0/s1

inchikey

  • UTNFYOAWBFBPFR-FHWLQOOXSA-N

mass

  • 429.470

monoisotopicmass

  • 429.20122

smiles

  • COC1=CC=CC(=C1)NC(=O)N[C@H]2CC[C@H](O[C@H]2CO)CC(=O)NCC3=NC=NC=C3

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:118590

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