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

Preferred term

ile-asn-thr  

Type

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

Broader concept

charge

  • 0

formula

  • C14H26N4O6

inchi

  • InChI=1S/C14H26N4O6/c1-4-6(2)10(16)13(22)17-8(5-9(15)20)12(21)18-11(7(3)19)14(23)24/h6-8,10-11,19H,4-5,16H2,1-3H3,(H2,15,20)(H,17,22)(H,18,21)(H,23,24)/t6-,7+,8-,10-,11-/m0/s1

inchikey

  • NCSIQAFSIPHVAN-IUKAMOBKSA-N

mass

  • 346.384

monoisotopicmass

  • 346.18523

smiles

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

subset

  • 2_STAR

synonym EXACT

  • (2S,3R)-2-[[(2S)-4-amino-2-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]-4-oxobutanoyl]amino]-3-hydroxybutanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:158240

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