skip to main content

Chemistry, part 1

Content language

Contact us: CRM@email.irandoc.ac.ir

Concept information

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

Preferred term

gly-asp-his  

Type

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

Broader concept

charge

  • 0

formula

  • C12H17N5O6

inchi

  • InChI=1S/C12H17N5O6/c13-3-9(18)16-7(2-10(19)20)11(21)17-8(12(22)23)1-6-4-14-5-15-6/h4-5,7-8H,1-3,13H2,(H,14,15)(H,16,18)(H,17,21)(H,19,20)(H,22,23)/t7-,8-/m0/s1

inchikey

  • LLXVQPKEQQCISF-YUMQZZPRSA-N

mass

  • 327.297

monoisotopicmass

  • 327.11788

smiles

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

subset

  • 2_STAR

synonym EXACT

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

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:163539

Download this concept:

RDF/XML TURTLE JSON-LD