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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-phe
organooxygen compound > carboxamide > peptide > thr-met-phe
... > 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-phe
... > 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-phe
... > 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-phe

Preferred term

thr-met-phe  

Type

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

Broader concept

charge

  • 0

formula

  • C18H27N3O5S

inchi

  • InChI=1S/C18H27N3O5S/c1-11(22)15(19)17(24)20-13(8-9-27-2)16(23)21-14(18(25)26)10-12-6-4-3-5-7-12/h3-7,11,13-15,22H,8-10,19H2,1-2H3,(H,20,24)(H,21,23)(H,25,26)/t11-,13+,14+,15+/m1/s1

inchikey

  • CGCMNOIQVAXYMA-UNQGMJICSA-N

mass

  • 397.490

monoisotopicmass

  • 397.16714

smiles

  • S(CC[C@H](NC(=O)[C@@H](N)[C@H](O)C)C(=O)N[C@@H](CC1=CC=CC=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-phenylpropanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:164114

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