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Contact us: CRM@email.irandoc.ac.ir

Concept information

Preferred term

n-[(2s,3r,6s)-6-[2-[[(2-fluorophenyl)-oxomethyl]amino]ethyl]-2-(hydroxymethyl)-3-oxanyl]-2-pyrazinecarboxamide  

Type

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

Broader concept

charge

  • 0

formula

  • C20H23FN4O4

inchi

  • InChI=1S/C20H23FN4O4/c21-15-4-2-1-3-14(15)19(27)24-8-7-13-5-6-16(18(12-26)29-13)25-20(28)17-11-22-9-10-23-17/h1-4,9-11,13,16,18,26H,5-8,12H2,(H,24,27)(H,25,28)/t13-,16+,18+/m0/s1

inchikey

  • NKWQDAXEZMPWOL-FDQGKXFDSA-N

mass

  • 402.420

monoisotopicmass

  • 402.17033

smiles

  • C1C[C@H]([C@H](O[C@@H]1CCNC(=O)C2=CC=CC=C2F)CO)NC(=O)C3=NC=CN=C3

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:120148

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