EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:164246 - Thr-Thr-Arg

Default Structure
ChEBI IDCHEBI:164246
ChEBI NameThr-Thr-Arg
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H28N6O6
Net Charge0
Average Mass376.414
Monoisotopic Mass376.20703
SMILESC[C@@H](O)[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](CCCN=C(N)N)C(=O)O)[C@@H](C)O
InChIInChI=1S/C14H28N6O6/c1-6(21)9(15)11(23)20-10(7(2)22)12(24)19-8(13(25)26)4-3-5-18-14(16)17/h6-10,21-22H,3-5,15H2,1-2H3,(H,19,24)(H,20,23)(H,25,26)(H4,16,17,18)/t6-,7-,8+,9+,10+/m1/s1
InChIKeyQYDKSNXSBXZPFK-ZJDVBMNYSA-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-Thr-Arg (CHEBI:164246) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S)-2-[[(2S,3R)-2-[[(2S,3R)-2-amino-3-hydroxybutanoyl]amino]-3-hydroxybutanoyl]amino]-5-(diaminomethylideneamino)pentanoic acid
Manual XrefsDatabases
14543400ChemSpider