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

Preferred term

his-glu-ile  

Type

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

Broader concept

charge

  • 0

formula

  • C17H27N5O6

inchi

  • InChI=1S/C17H27N5O6/c1-3-9(2)14(17(27)28)22-16(26)12(4-5-13(23)24)21-15(25)11(18)6-10-7-19-8-20-10/h7-9,11-12,14H,3-6,18H2,1-2H3,(H,19,20)(H,21,25)(H,22,26)(H,23,24)(H,27,28)/t9-,11-,12-,14-/m0/s1

inchikey

  • HQKADFMLECZIQJ-HVTMNAMFSA-N

mass

  • 397.432

monoisotopicmass

  • 397.19613

smiles

  • O=C(N[C@@H]([C@H](CC)C)C(O)=O)[C@@H](NC(=O)[C@@H](N)CC=1NC=NC1)CCC(O)=O

subset

  • 2_STAR

synonym EXACT

  • (2S,3S)-2-[[(2S)-2-[[(2S)-2-amino-3-(1H-imidazol-5-yl)propanoyl]amino]-4-carboxybutanoyl]amino]-3-methylpentanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:164446

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