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Chemistry, part 1

Content language

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

Preferred term

asp-cys-his  

Type

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

Broader concept

charge

  • 0

formula

  • C13H19N5O6S

inchi

  • InChI=1S/C13H19N5O6S/c14-7(2-10(19)20)11(21)18-9(4-25)12(22)17-8(13(23)24)1-6-3-15-5-16-6/h3,5,7-9,25H,1-2,4,14H2,(H,15,16)(H,17,22)(H,18,21)(H,19,20)(H,23,24)/t7-,8-,9-/m0/s1

inchikey

  • IAMNNSSEBXDJMN-CIUDSAMLSA-N

mass

  • 373.380

monoisotopicmass

  • 373.10560

smiles

  • SC[C@H](NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](CC=1NC=NC1)C(O)=O

subset

  • 2_STAR

synonym EXACT

  • (3S)-3-amino-4-[[(2R)-1-[[(1S)-1-carboxy-2-(1H-imidazol-5-yl)ethyl]amino]-1-oxo-3-sulanylpropan-2-yl]amino]-4-oxobutanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:160453

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