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

Preferred term

asn-phe-tyr  

Type

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

Broader concept

charge

  • 0

formula

  • C22H26N4O6

inchi

  • InChI=1S/C22H26N4O6/c23-16(12-19(24)28)20(29)25-17(10-13-4-2-1-3-5-13)21(30)26-18(22(31)32)11-14-6-8-15(27)9-7-14/h1-9,16-18,27H,10-12,23H2,(H2,24,28)(H,25,29)(H,26,30)(H,31,32)/t16-,17-,18-/m0/s1

inchikey

  • RBOBTTLFPRSXKZ-BZSNNMDCSA-N

mass

  • 442.472

monoisotopicmass

  • 442.18523

smiles

  • O=C(N[C@@H](CC1=CC=C(O)C=C1)C(O)=O)[C@@H](NC(=O)[C@@H](N)CC(=O)N)CC2=CC=CC=C2

subset

  • 2_STAR

synonym EXACT

  • (2S)-2-[[(2S)-2-[[(2S)-2,4-diamino-4-oxobutanoyl]amino]-3-phenylpropanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:160032

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