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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)-3-(hydroxymethyl)-n2-[2-(1-methyl-4-imidazolyl)ethyl]-6-oxo-n1-phenyl-3,3a,4,9b-tetrahydro-2h-pyrrolo[2,3-a]indolizine-1,2-dicarboxamide
... > 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)-3-(hydroxymethyl)-n2-[2-(1-methyl-4-imidazolyl)ethyl]-6-oxo-n1-phenyl-3,3a,4,9b-tetrahydro-2h-pyrrolo[2,3-a]indolizine-1,2-dicarboxamide
organooxygen compound > carboxamide > amino acid amide > (2s,3s,3ar,9br)-3-(hydroxymethyl)-n2-[2-(1-methyl-4-imidazolyl)ethyl]-6-oxo-n1-phenyl-3,3a,4,9b-tetrahydro-2h-pyrrolo[2,3-a]indolizine-1,2-dicarboxamide
... > 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)-3-(hydroxymethyl)-n2-[2-(1-methyl-4-imidazolyl)ethyl]-6-oxo-n1-phenyl-3,3a,4,9b-tetrahydro-2h-pyrrolo[2,3-a]indolizine-1,2-dicarboxamide

Preferred term

(2s,3s,3ar,9br)-3-(hydroxymethyl)-n2-[2-(1-methyl-4-imidazolyl)ethyl]-6-oxo-n1-phenyl-3,3a,4,9b-tetrahydro-2h-pyrrolo[2,3-a]indolizine-1,2-dicarboxamide  

Type

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

Broader concept

charge

  • 0

formula

  • C25H28N6O4

inchi

  • InChI=1S/C25H28N6O4/c1-29-12-17(27-15-29)10-11-26-24(34)23-19(14-32)18-13-30-20(8-5-9-21(30)33)22(18)31(23)25(35)28-16-6-3-2-4-7-16/h2-9,12,15,18-19,22-23,32H,10-11,13-14H2,1H3,(H,26,34)(H,28,35)/t18-,19-,22+,23-/m0/s1

inchikey

  • WOLKNTYXBIJULP-LBVMUVSTSA-N

mass

  • 476.529

monoisotopicmass

  • 476.21720

smiles

  • CN1C=C(N=C1)CCNC(=O)[C@@H]2[C@H]([C@@H]3CN4C(=O)C=CC=C4[C@@H]3N2C(=O)NC5=CC=CC=C5)CO

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:102753

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