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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-(cyclohexylmethyl)-n-ethyl-3-(hydroxymethyl)-6-oxo-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-(cyclohexylmethyl)-n-ethyl-3-(hydroxymethyl)-6-oxo-3,3a,4,9b-tetrahydro-2h-pyrrolo[2,3-a]indolizine-2-carboxamide
organooxygen compound > carboxamide > amino acid amide > (2r,3r,3as,9bs)-1-(cyclohexylmethyl)-n-ethyl-3-(hydroxymethyl)-6-oxo-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-(cyclohexylmethyl)-n-ethyl-3-(hydroxymethyl)-6-oxo-3,3a,4,9b-tetrahydro-2h-pyrrolo[2,3-a]indolizine-2-carboxamide

Preferred term

(2r,3r,3as,9bs)-1-(cyclohexylmethyl)-n-ethyl-3-(hydroxymethyl)-6-oxo-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

  • C21H31N3O3

inchi

  • InChI=1S/C21H31N3O3/c1-2-22-21(27)20-16(13-25)15-12-23-17(9-6-10-18(23)26)19(15)24(20)11-14-7-4-3-5-8-14/h6,9-10,14-16,19-20,25H,2-5,7-8,11-13H2,1H3,(H,22,27)/t15-,16-,19+,20-/m1/s1

inchikey

  • ZLPHSXDBJGBVPE-YAJHFMINSA-N

mass

  • 373.490

monoisotopicmass

  • 373.23654

smiles

  • CCNC(=O)[C@H]1[C@@H]([C@H]2CN3C(=O)C=CC=C3[C@H]2N1CC4CCCCC4)CO

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:101753

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