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Chemistry, part 1

Content language

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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 > peptide > pro-trp-ile
organooxygen compound > carboxamide > peptide > pro-trp-ile
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > peptide > pro-trp-ile
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic amino compound > peptide > pro-trp-ile
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organic amino compound > peptide > pro-trp-ile

Preferred term

pro-trp-ile  

Type

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

Broader concept

charge

  • 0

formula

  • C22H30N4O4

inchi

  • InChI=1S/C22H30N4O4/c1-3-13(2)19(22(29)30)26-21(28)18(25-20(27)17-9-6-10-23-17)11-14-12-24-16-8-5-4-7-15(14)16/h4-5,7-8,12-13,17-19,23-24H,3,6,9-11H2,1-2H3,(H,25,27)(H,26,28)(H,29,30)/t13-,17-,18-,19-/m0/s1

inchikey

  • VVEQUISRWJDGMX-VKOGCVSHSA-N

mass

  • 414.506

monoisotopicmass

  • 414.22671

smiles

  • O=C(N[C@@H](CC=1C=2C(NC1)=CC=CC2)C(=O)N[C@@H]([C@H](CC)C)C(O)=O)[C@H]3NCCC3

subset

  • 2_STAR

synonym EXACT

  • (2S,3S)-2-[[(2S)-3-(1H-indol-3-yl)-2-[[(2S)-pyrrolidine-2-carbonyl]amino]propanoyl]amino]-3-methylpentanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:162715

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