EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:160149 - Asn-Thr-Thr

ChEBI IDCHEBI:160149
ChEBI NameAsn-Thr-Thr
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H22N4O7
Net Charge0
Average Mass334.329
Monoisotopic Mass334.14885
SMILESC[C@@H](O)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CC(N)=O)[C@@H](C)O)C(=O)O
InChIInChI=1S/C12H22N4O7/c1-4(17)8(15-10(20)6(13)3-7(14)19)11(21)16-9(5(2)18)12(22)23/h4-6,8-9,17-18H,3,13H2,1-2H3,(H2,14,19)(H,15,20)(H,16,21)(H,22,23)/t4-,5-,6+,8+,9+/m1/s1
InChIKeyUXHYOWXTJLBEPG-GSSVUCPTSA-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-Thr (CHEBI:160149) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S,3R)-2-[[(2S,3R)-2-[[(2S)-2,4-diamino-4-oxobutanoyl]amino]-3-hydroxybutanoyl]amino]-3-hydroxybutanoic acid