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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 > oligopeptide > dipeptide > (3s)-3-azaniumyl-4-[[(1s)-1-carboxylato-2-phenylethyl]amino]-4-oxobutanoate
... > organooxygen compound > carboxamide > peptide > oligopeptide > dipeptide > (3s)-3-azaniumyl-4-[[(1s)-1-carboxylato-2-phenylethyl]amino]-4-oxobutanoate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > peptide > oligopeptide > dipeptide > (3s)-3-azaniumyl-4-[[(1s)-1-carboxylato-2-phenylethyl]amino]-4-oxobutanoate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic amino compound > peptide > oligopeptide > dipeptide > (3s)-3-azaniumyl-4-[[(1s)-1-carboxylato-2-phenylethyl]amino]-4-oxobutanoate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organic amino compound > peptide > oligopeptide > dipeptide > (3s)-3-azaniumyl-4-[[(1s)-1-carboxylato-2-phenylethyl]amino]-4-oxobutanoate

Preferred term

(3s)-3-azaniumyl-4-[[(1s)-1-carboxylato-2-phenylethyl]amino]-4-oxobutanoate  

Type

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

Broader concept

charge

  • -1

formula

  • C13H15N2O5

inchi

  • InChI=1S/C13H16N2O5/c14-9(7-11(16)17)12(18)15-10(13(19)20)6-8-4-2-1-3-5-8/h1-5,9-10H,6-7,14H2,(H,15,18)(H,16,17)(H,19,20)/p-1/t9-,10-/m0/s1

inchikey

  • YZQCXOFQZKCETR-UWVGGRQHSA-M

mass

  • 279.273

monoisotopicmass

  • 279.09865

smiles

  • O=C(N[C@@H](CC1=CC=CC=C1)C([O-])=O)[C@@H]([NH3+])CC([O-])=O

subset

  • 2_STAR

synonym EXACT

  • (3S)-3-azaniumyl-4-[[(1S)-1-carboxylato-2-phenylethyl]amino]-4-oxobutanoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:181447

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