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

Preferred term

thr-met-tyr  

Type

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

Broader concept

charge

  • 0

formula

  • C18H27N3O6S

inchi

  • InChI=1S/C18H27N3O6S/c1-10(22)15(19)17(25)20-13(7-8-28-2)16(24)21-14(18(26)27)9-11-3-5-12(23)6-4-11/h3-6,10,13-15,22-23H,7-9,19H2,1-2H3,(H,20,25)(H,21,24)(H,26,27)/t10-,13+,14+,15+/m1/s1

inchikey

  • FDQXPJCLVPFKJW-KJEVXHAQSA-N

mass

  • 413.490

monoisotopicmass

  • 413.16206

smiles

  • S(CC[C@H](NC(=O)[C@@H](N)[C@H](O)C)C(=O)N[C@@H](CC1=CC=C(O)C=C1)C(O)=O)C

subset

  • 2_STAR

synonym EXACT

  • (2S)-2-[[(2S)-2-[[(2S,3R)-2-amino-3-hydroxybutanoyl]amino]-4-methylsulanylbutanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:164124

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