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

Preferred term

ile-val-asp  

Type

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

Broader concept

charge

  • 0

formula

  • C15H27N3O6

inchi

  • InChI=1S/C15H27N3O6/c1-5-8(4)11(16)13(21)18-12(7(2)3)14(22)17-9(15(23)24)6-10(19)20/h7-9,11-12H,5-6,16H2,1-4H3,(H,17,22)(H,18,21)(H,19,20)(H,23,24)/t8-,9-,11-,12-/m0/s1

inchikey

  • BCISUQVFDGYZBO-QSFUFRPTSA-N

mass

  • 345.396

monoisotopicmass

  • 345.18999

smiles

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

subset

  • 2_STAR

synonym EXACT

  • (2S)-2-[[(2S)-2-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]-3-methylbutanoyl]amino]butanedioic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:158895

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