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

Preferred term

ile-lys-his  

Type

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

Broader concept

charge

  • 0

formula

  • C18H32N6O4

inchi

  • InChI=1S/C18H32N6O4/c1-3-11(2)15(20)17(26)23-13(6-4-5-7-19)16(25)24-14(18(27)28)8-12-9-21-10-22-12/h9-11,13-15H,3-8,19-20H2,1-2H3,(H,21,22)(H,23,26)(H,24,25)(H,27,28)/t11-,13-,14-,15-/m0/s1

inchikey

  • XDUVMJCBYUKNFJ-MXAVVETBSA-N

mass

  • 396.492

monoisotopicmass

  • 396.24850

smiles

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

subset

  • 2_STAR

synonym EXACT

  • (2S)-2-[[(2S)-6-amino-2-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]hexanoyl]amino]-3-(1H-imidazol-5-yl)propanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:158586

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