skip to main content

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

Preferred term

pro-val-trp  

Type

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

Broader concept

charge

  • 0

formula

  • C21H28N4O4

inchi

  • InChI=1S/C21H28N4O4/c1-12(2)18(25-19(26)16-8-5-9-22-16)20(27)24-17(21(28)29)10-13-11-23-15-7-4-3-6-14(13)15/h3-4,6-7,11-12,16-18,22-23H,5,8-10H2,1-2H3,(H,24,27)(H,25,26)(H,28,29)/t16-,17-,18-/m0/s1

inchikey

  • MTMJNKFZDQEVSY-BZSNNMDCSA-N

mass

  • 400.479

monoisotopicmass

  • 400.21106

smiles

  • O=C(N[C@@H](C(C)C)C(=O)N[C@@H](CC=1C=2C(NC1)=CC=CC2)C(O)=O)[C@H]3NCCC3

subset

  • 2_STAR

synonym EXACT

  • (2S)-3-(1H-indol-3-yl)-2-[[(2S)-3-methyl-2-[[(2S)-pyrrolidine-2-carbonyl]amino]butanoyl]amino]propanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:162811

Download this concept:

RDF/XML TURTLE JSON-LD