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

Preferred term

asn-pro-thr  

Type

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

Broader concept

charge

  • 0

formula

  • C13H22N4O6

inchi

  • InChI=1S/C13H22N4O6/c1-6(18)10(13(22)23)16-11(20)8-3-2-4-17(8)12(21)7(14)5-9(15)19/h6-8,10,18H,2-5,14H2,1H3,(H2,15,19)(H,16,20)(H,22,23)/t6-,7+,8+,10+/m1/s1

inchikey

  • IDUUACUJKUXKKD-VEVYYDQMSA-N

mass

  • 330.341

monoisotopicmass

  • 330.15393

smiles

  • O=C(N[C@@H]([C@H](O)C)C(O)=O)[C@H]1N(CCC1)C(=O)[C@@H](N)CC(=O)N

subset

  • 2_STAR

synonym EXACT

  • (2S,3R)-2-[[(2S)-1-[(2S)-2,4-diamino-4-oxobutanoyl]pyrrolidine-2-carbonyl]amino]-3-hydroxybutanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:160068

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