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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 > amino-acid derivative > amino acid amide > (2r,3r,3as,9bs)-1-[cyclopropyl(oxo)methyl]-3-(hydroxymethyl)-6-oxo-n-(2,2,2-trifluoroethyl)-3,3a,4,9b-tetrahydro-2h-pyrrolo[2,3-a]indolizine-2-carboxamide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > carboxamide > amino acid amide > (2r,3r,3as,9bs)-1-[cyclopropyl(oxo)methyl]-3-(hydroxymethyl)-6-oxo-n-(2,2,2-trifluoroethyl)-3,3a,4,9b-tetrahydro-2h-pyrrolo[2,3-a]indolizine-2-carboxamide
organooxygen compound > carboxamide > amino acid amide > (2r,3r,3as,9bs)-1-[cyclopropyl(oxo)methyl]-3-(hydroxymethyl)-6-oxo-n-(2,2,2-trifluoroethyl)-3,3a,4,9b-tetrahydro-2h-pyrrolo[2,3-a]indolizine-2-carboxamide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > amino acid amide > (2r,3r,3as,9bs)-1-[cyclopropyl(oxo)methyl]-3-(hydroxymethyl)-6-oxo-n-(2,2,2-trifluoroethyl)-3,3a,4,9b-tetrahydro-2h-pyrrolo[2,3-a]indolizine-2-carboxamide

Preferred term

(2r,3r,3as,9bs)-1-[cyclopropyl(oxo)methyl]-3-(hydroxymethyl)-6-oxo-n-(2,2,2-trifluoroethyl)-3,3a,4,9b-tetrahydro-2h-pyrrolo[2,3-a]indolizine-2-carboxamide  

Type

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

Broader concept

charge

  • 0

formula

  • C18H20F3N3O4

inchi

  • InChI=1S/C18H20F3N3O4/c19-18(20,21)8-22-16(27)15-11(7-25)10-6-23-12(2-1-3-13(23)26)14(10)24(15)17(28)9-4-5-9/h1-3,9-11,14-15,25H,4-8H2,(H,22,27)/t10-,11-,14+,15-/m1/s1

inchikey

  • HYHGLNWEXAHCEQ-HKCMKHECSA-N

mass

  • 399.365

monoisotopicmass

  • 399.14059

smiles

  • C1CC1C(=O)N2[C@H]3[C@H](CN4C3=CC=CC4=O)[C@H]([C@@H]2C(=O)NCC(F)(F)F)CO

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:101055

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