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CHEBI:163720 - Thr-Asn-Thr

Default Structure
ChEBI IDCHEBI:163720
ChEBI NameThr-Asn-Thr
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H22N4O7
Net Charge0
Average Mass334.329
Monoisotopic Mass334.14885
SMILESC[C@@H](O)[C@H](N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)O)[C@@H](C)O
InChIInChI=1S/C12H22N4O7/c1-4(17)8(14)11(21)15-6(3-7(13)19)10(20)16-9(5(2)18)12(22)23/h4-6,8-9,17-18H,3,14H2,1-2H3,(H2,13,19)(H,15,21)(H,16,20)(H,22,23)/t4-,5-,6+,8+,9+/m1/s1
InChIKeyPQLXHSACXPGWPD-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)
Thr-Asn-Thr (CHEBI:163720) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S,3R)-2-[[(2S)-4-amino-2-[[(2S,3R)-2-amino-3-hydroxybutanoyl]amino]-4-oxobutanoyl]amino]-3-hydroxybutanoic acid