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Chemistry, part 1

Content language

Contact us: CRM@email.irandoc.ac.ir

Concept information

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

Preferred term

gln-asp-asp  

Type

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

Broader concept

charge

  • 0

formula

  • C13H20N4O9

inchi

  • InChI=1S/C13H20N4O9/c14-5(1-2-8(15)18)11(23)16-6(3-9(19)20)12(24)17-7(13(25)26)4-10(21)22/h5-7H,1-4,14H2,(H2,15,18)(H,16,23)(H,17,24)(H,19,20)(H,21,22)(H,25,26)/t5-,6-,7-/m0/s1

inchikey

  • ULXXDWZMMSQBDC-ACZMJKKPSA-N

mass

  • 376.322

monoisotopicmass

  • 376.12303

smiles

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

subset

  • 2_STAR

synonym EXACT

  • (2S)-2-[[(2S)-3-carboxy-2-[[(2S)-2,5-diamino-5-oxopentanoyl]amino]propanoyl]amino]butanedioic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:161987

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