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

Preferred term

his-gln-tyr  

Type

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

Broader concept

charge

  • 0

formula

  • C20H26N6O6

inchi

  • InChI=1S/C20H26N6O6/c21-14(8-12-9-23-10-24-12)18(29)25-15(5-6-17(22)28)19(30)26-16(20(31)32)7-11-1-3-13(27)4-2-11/h1-4,9-10,14-16,27H,5-8,21H2,(H2,22,28)(H,23,24)(H,25,29)(H,26,30)(H,31,32)/t14-,15-,16-/m0/s1

inchikey

  • FMRKUXFLLPKVPG-JYJNAYRXSA-N

mass

  • 446.464

monoisotopicmass

  • 446.19138

smiles

  • O=C(N[C@@H](CC1=CC=C(O)C=C1)C(O)=O)[C@@H](NC(=O)[C@@H](N)CC=2NC=NC2)CCC(=O)N

subset

  • 2_STAR

synonym EXACT

  • (2S)-2-[[(2S)-5-amino-2-[[(2S)-2-amino-3-(1H-imidazol-5-yl)propanoyl]amino]-5-oxopentanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:164425

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