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

Preferred term

ile-asn-gln  

Type

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

Broader concept

charge

  • 0

formula

  • C15H27N5O6

inchi

  • InChI=1S/C15H27N5O6/c1-3-7(2)12(18)14(24)20-9(6-11(17)22)13(23)19-8(15(25)26)4-5-10(16)21/h7-9,12H,3-6,18H2,1-2H3,(H2,16,21)(H2,17,22)(H,19,23)(H,20,24)(H,25,26)/t7-,8-,9-,12-/m0/s1

inchikey

  • PJLLMGWWINYQPB-PEFMBERDSA-N

mass

  • 373.410

monoisotopicmass

  • 373.19613

smiles

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

subset

  • 2_STAR

synonym EXACT

  • (2S)-5-amino-2-[[(2S)-4-amino-2-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]-4-oxobutanoyl]amino]-5-oxopentanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:158217

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