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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > ureas > n-(cyclohexylmethyl)-2-[(2s,3s,6r)-3-[[(3-fluoroanilino)-oxomethyl]amino]-2-(hydroxymethyl)-3,6-dihydro-2h-pyran-6-yl]acetamide

Preferred term

n-(cyclohexylmethyl)-2-[(2s,3s,6r)-3-[[(3-fluoroanilino)-oxomethyl]amino]-2-(hydroxymethyl)-3,6-dihydro-2h-pyran-6-yl]acetamide  

Type

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

Broader concept

charge

  • 0

formula

  • C22H30FN3O4

inchi

  • InChI=1S/C22H30FN3O4/c23-16-7-4-8-17(11-16)25-22(29)26-19-10-9-18(30-20(19)14-27)12-21(28)24-13-15-5-2-1-3-6-15/h4,7-11,15,18-20,27H,1-3,5-6,12-14H2,(H,24,28)(H2,25,26,29)/t18-,19-,20+/m0/s1

inchikey

  • PGYGWAGYUXBZHY-SLFFLAALSA-N

mass

  • 419.491

monoisotopicmass

  • 419.22203

smiles

  • C1CCC(CC1)CNC(=O)C[C@@H]2C=C[C@@H]([C@H](O2)CO)NC(=O)NC3=CC(=CC=C3)F

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:99210

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