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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 > (2s,3s,3ar,9br)-1-[(2,5-difluorophenyl)methyl]-3-(hydroxymethyl)-2-[4-morpholinyl(oxo)methyl]-3,3a,4,9b-tetrahydro-2h-pyrrolo[2,3-a]indolizin-6-one
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > carboxamide > amino acid amide > (2s,3s,3ar,9br)-1-[(2,5-difluorophenyl)methyl]-3-(hydroxymethyl)-2-[4-morpholinyl(oxo)methyl]-3,3a,4,9b-tetrahydro-2h-pyrrolo[2,3-a]indolizin-6-one
organooxygen compound > carboxamide > amino acid amide > (2s,3s,3ar,9br)-1-[(2,5-difluorophenyl)methyl]-3-(hydroxymethyl)-2-[4-morpholinyl(oxo)methyl]-3,3a,4,9b-tetrahydro-2h-pyrrolo[2,3-a]indolizin-6-one
... > 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 > (2s,3s,3ar,9br)-1-[(2,5-difluorophenyl)methyl]-3-(hydroxymethyl)-2-[4-morpholinyl(oxo)methyl]-3,3a,4,9b-tetrahydro-2h-pyrrolo[2,3-a]indolizin-6-one

Preferred term

(2s,3s,3ar,9br)-1-[(2,5-difluorophenyl)methyl]-3-(hydroxymethyl)-2-[4-morpholinyl(oxo)methyl]-3,3a,4,9b-tetrahydro-2h-pyrrolo[2,3-a]indolizin-6-one  

Type

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

Broader concept

charge

  • 0

formula

  • C23H25F2N3O4

inchi

  • InChI=1S/C23H25F2N3O4/c24-15-4-5-18(25)14(10-15)11-28-21-16(12-27-19(21)2-1-3-20(27)30)17(13-29)22(28)23(31)26-6-8-32-9-7-26/h1-5,10,16-17,21-22,29H,6-9,11-13H2/t16-,17-,21+,22-/m0/s1

inchikey

  • LANSPELNPINRAU-QPAOKJHLSA-N

mass

  • 445.460

monoisotopicmass

  • 445.18131

smiles

  • C1COCCN1C(=O)[C@@H]2[C@H]([C@@H]3CN4C(=O)C=CC=C4[C@@H]3N2CC5=C(C=CC(=C5)F)F)CO

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:99152

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