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CHEBI:160121 - Asn-Thr-Asp

ChEBI IDCHEBI:160121
ChEBI NameAsn-Thr-Asp
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H20N4O8
Net Charge0
Average Mass348.312
Monoisotopic Mass348.12811
SMILESC[C@@H](O)[C@H](NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)O
InChIInChI=1S/C12H20N4O8/c1-4(17)9(16-10(21)5(13)2-7(14)18)11(22)15-6(12(23)24)3-8(19)20/h4-6,9,17H,2-3,13H2,1H3,(H2,14,18)(H,15,22)(H,16,21)(H,19,20)(H,23,24)/t4-,5+,6+,9+/m1/s1
InChIKeyHPASIOLTWSNMFB-OLHMAJIHSA-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)
Asn-Thr-Asp (CHEBI:160121) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S,3R)-2-[[(2S)-2,4-diamino-4-oxobutanoyl]amino]-3-hydroxybutanoyl]amino]butanedioic acid