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

Preferred term

asn-glu-glu  

Type

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

Broader concept

charge

  • 0

formula

  • C14H22N4O9

inchi

  • InChI=1S/C14H22N4O9/c15-6(5-9(16)19)12(24)17-7(1-3-10(20)21)13(25)18-8(14(26)27)2-4-11(22)23/h6-8H,1-5,15H2,(H2,16,19)(H,17,24)(H,18,25)(H,20,21)(H,22,23)(H,26,27)/t6-,7-,8-/m0/s1

inchikey

  • BZMWJLLUAKSIMH-FXQIFTODSA-N

mass

  • 390.349

monoisotopicmass

  • 390.13868

smiles

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

subset

  • 2_STAR

synonym EXACT

  • (2S)-2-[[(2S)-4-carboxy-2-[[(2S)-2,4-diamino-4-oxobutanoyl]amino]butanoyl]amino]pentanedioic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:159727

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