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Chemistry, part 1

Content language

Contact us: CRM@email.irandoc.ac.ir

Concept information

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

Preferred term

val-thr-trp  

Type

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

Broader concept

charge

  • 0

formula

  • C20H28N4O5

inchi

  • InChI=1S/C20H28N4O5/c1-10(2)16(21)18(26)24-17(11(3)25)19(27)23-15(20(28)29)8-12-9-22-14-7-5-4-6-13(12)14/h4-7,9-11,15-17,22,25H,8,21H2,1-3H3,(H,23,27)(H,24,26)(H,28,29)/t11-,15+,16+,17+/m1/s1

inchikey

  • UEXPMFIAZZHEAD-HSHDSVGOSA-N

mass

  • 404.467

monoisotopicmass

  • 404.20597

smiles

  • O[C@@H]([C@H](NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](CC=1C=2C(NC1)=CC=CC2)C(O)=O)C

subset

  • 2_STAR

synonym EXACT

  • (2S)-2-[[(2S,3R)-2-[[(2S)-2-amino-3-methylbutanoyl]amino]-3-hydroxybutanoyl]amino]-3-(1H-indol-3-yl)propanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:166390

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