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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 > tyr-pro-thr
organooxygen compound > carboxamide > peptide > tyr-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 > tyr-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 > tyr-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 > tyr-pro-thr

Preferred term

tyr-pro-thr  

Type

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

Broader concept

charge

  • 0

formula

  • C18H25N3O6

inchi

  • InChI=1S/C18H25N3O6/c1-10(22)15(18(26)27)20-16(24)14-3-2-8-21(14)17(25)13(19)9-11-4-6-12(23)7-5-11/h4-7,10,13-15,22-23H,2-3,8-9,19H2,1H3,(H,20,24)(H,26,27)/t10-,13+,14+,15+/m1/s1

inchikey

  • XGZBEGGGAUQBMB-KJEVXHAQSA-N

mass

  • 379.413

monoisotopicmass

  • 379.17434

smiles

  • O=C(N[C@@H]([C@H](O)C)C(O)=O)[C@H]1N(CCC1)C(=O)[C@@H](N)CC2=CC=C(O)C=C2

subset

  • 2_STAR

synonym EXACT

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

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:165951

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