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CHEBI:166935 - Met-Glu-Ile-Arg

ChEBI IDCHEBI:166935
ChEBI NameMet-Glu-Ile-Arg
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H41N7O7S
Net Charge0
Average Mass547.679
Monoisotopic Mass547.27882
SMILESCC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CCSC)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O
InChIInChI=1S/C22H41N7O7S/c1-4-12(2)17(20(34)28-15(21(35)36)6-5-10-26-22(24)25)29-19(33)14(7-8-16(30)31)27-18(32)13(23)9-11-37-3/h12-15,17H,4-11,23H2,1-3H3,(H,27,32)(H,28,34)(H,29,33)(H,30,31)(H,35,36)(H4,24,25,26)/t12-,13-,14-,15-,17-/m0/s1
InChIKeyJQTOSAPHLXRNAH-BWJWTDLKSA-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)
Met-Glu-Ile-Arg (CHEBI:166935) is a tetrapeptide (CHEBI:48030)
IUPAC Name 
(2S)-2-[(2S,3S)-2-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-4-carboxybutanamido]-3-methylpentanamido]-5-carbamimidamidopentanoic acid