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Chemistry, part 1

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > carboxamide > eliglustat
organooxygen compound > carboxamide > eliglustat
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > eliglustat
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic amino compound > tertiary amino compound > n-alkylpyrrolidine > eliglustat
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organic amino compound > tertiary amino compound > n-alkylpyrrolidine > eliglustat
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organonitrogen heterocyclic compound > pyrrolidines > n-alkylpyrrolidine > eliglustat
organic heterocyclic compound > organonitrogen heterocyclic compound > pyrrolidines > n-alkylpyrrolidine > eliglustat
organic heterocyclic compound > organic heteromonocyclic compound > pyrrolidines > n-alkylpyrrolidine > eliglustat

Preferred term

eliglustat  

Type

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

Broader concept

charge

  • 0

formula

  • C23H36N2O4

has_role

inchi

  • InChI=1S/C23H36N2O4/c1-2-3-4-5-6-9-22(26)24-19(17-25-12-7-8-13-25)23(27)18-10-11-20-21(16-18)29-15-14-28-20/h10-11,16,19,23,27H,2-9,12-15,17H2,1H3,(H,24,26)/t19-,23-/m1/s1

inchikey

  • FJZZPCZKBUKGGU-AUSIDOKSSA-N

is_conjugate_base_of

mass

  • 404.54290

monoisotopicmass

  • 404.26751

smiles

  • CCCCCCCC(=O)N[C@H](CN1CCCC1)[C@H](O)c1ccc2OCCOc2c1

subset

  • 3_STAR

synonym EXACT

  • N-[(1R,2R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-hydroxy-3-(pyrrolidin-1-yl)propan-2-yl]octanamide

synonym RELATED

  • eliglustat
  • Genz 99067
  • Genz-99067

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:82752

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