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CHEBI:160603 - Asp-His-Gly

ChEBI IDCHEBI:160603
ChEBI NameAsp-His-Gly
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H17N5O6
Net Charge0
Average Mass327.297
Monoisotopic Mass327.11788
SMILESN[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1cncn1)C(=O)NCC(=O)O
InChIInChI=1S/C12H17N5O6/c13-7(2-9(18)19)11(22)17-8(1-6-3-14-5-16-6)12(23)15-4-10(20)21/h3,5,7-8H,1-2,4,13H2,(H,14,16)(H,15,23)(H,17,22)(H,18,19)(H,20,21)/t7-,8-/m0/s1
InChIKeyILQCHXURSRRIRY-YUMQZZPRSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Asp-His-Gly (CHEBI:160603) is a tripeptide (CHEBI:47923)
IUPAC Name 
(3S)-3-amino-4-[[(2S)-1-(carboxymethylamino)-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-4-oxobutanoic acid