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Concept information

Preferred term

n-[2-[(2r,5r,6r)-5-[[(3-fluoroanilino)-oxomethyl]amino]-6-(hydroxymethyl)-2-oxanyl]ethyl]-2-pyridin-4-ylacetamide  

Type

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

Broader concept

charge

  • 0

formula

  • C22H27FN4O4

inchi

  • InChI=1S/C22H27FN4O4/c23-16-2-1-3-17(13-16)26-22(30)27-19-5-4-18(31-20(19)14-28)8-11-25-21(29)12-15-6-9-24-10-7-15/h1-3,6-7,9-10,13,18-20,28H,4-5,8,11-12,14H2,(H,25,29)(H2,26,27,30)/t18-,19-,20+/m1/s1

inchikey

  • CAUJNQQMPJLGLW-AQNXPRMDSA-N

mass

  • 430.473

monoisotopicmass

  • 430.20163

smiles

  • C1C[C@H]([C@@H](O[C@H]1CCNC(=O)CC2=CC=NC=C2)CO)NC(=O)NC3=CC(=CC=C3)F

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:118465

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