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

Preferred term

ala-asp-thr  

Type

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

Broader concept

charge

  • 0

formula

  • C11H19N3O7

inchi

  • InChI=1S/C11H19N3O7/c1-4(12)9(18)13-6(3-7(16)17)10(19)14-8(5(2)15)11(20)21/h4-6,8,15H,3,12H2,1-2H3,(H,13,18)(H,14,19)(H,16,17)(H,20,21)/t4-,5+,6-,8-/m0/s1

inchikey

  • BTYTYHBSJKQBQA-GCJQMDKQSA-N

mass

  • 305.287

monoisotopicmass

  • 305.12230

smiles

  • O[C@@H]([C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)C)CC(O)=O)C(O)=O)C

subset

  • 2_STAR

synonym EXACT

  • (3S)-3-[[(2S)-2-aminopropanoyl]amino]-4-[[(1S,2R)-1-carboxy-2-hydroxypropyl]amino]-4-oxobutanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:158046

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