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

Preferred term

ile-trp-val  

Type

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

Broader concept

charge

  • 0

formula

  • C22H32N4O4

inchi

  • InChI=1S/C22H32N4O4/c1-5-13(4)18(23)21(28)25-17(20(27)26-19(12(2)3)22(29)30)10-14-11-24-16-9-7-6-8-15(14)16/h6-9,11-13,17-19,24H,5,10,23H2,1-4H3,(H,25,28)(H,26,27)(H,29,30)/t13-,17-,18-,19-/m0/s1

inchikey

  • MGUTVMBNOMJLKC-VKOGCVSHSA-N

mass

  • 416.522

monoisotopicmass

  • 416.24236

smiles

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

subset

  • 2_STAR

synonym EXACT

  • (2S)-2-[[(2S)-2-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-3-methylbutanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:158847

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