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

Concept information

Preferred term

n-[(2r,3s,6r)-6-[2-[[cyclohexyl(oxo)methyl]amino]ethyl]-2-(hydroxymethyl)-3-oxanyl]-2-pyridinecarboxamide  

Type

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

Broader concept

charge

  • 0

formula

  • C21H31N3O4

inchi

  • InChI=1S/C21H31N3O4/c25-14-19-17(24-21(27)18-8-4-5-12-22-18)10-9-16(28-19)11-13-23-20(26)15-6-2-1-3-7-15/h4-5,8,12,15-17,19,25H,1-3,6-7,9-11,13-14H2,(H,23,26)(H,24,27)/t16-,17+,19+/m1/s1

inchikey

  • VLQCPCSLOMVUJP-AOIWGVFYSA-N

mass

  • 389.489

monoisotopicmass

  • 389.23146

smiles

  • C1CCC(CC1)C(=O)NCC[C@H]2CC[C@@H]([C@@H](O2)CO)NC(=O)C3=CC=CC=N3

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:122462

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