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CHEBI:180574 - Trp-Thr-Gly-Cys

ChEBI IDCHEBI:180574
ChEBI NameTrp-Thr-Gly-Cys
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H27N5O6S
Net Charge0
Average Mass465.532
Monoisotopic Mass465.16820
SMILESCC(O)C(NC(=O)C(N)Cc1cnc2ccccc12)C(=O)NCC(=O)NC(CS)C(=O)O
InChIInChI=1S/C20H27N5O6S/c1-10(26)17(19(29)23-8-16(27)24-15(9-32)20(30)31)25-18(28)13(21)6-11-7-22-14-5-3-2-4-12(11)14/h2-5,7,10,13,15,17,22,26,32H,6,8-9,21H2,1H3,(H,23,29)(H,24,27)(H,25,28)(H,30,31)
InChIKeyWKBSMXJENZTPNS-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) pancreas (BTO:0000988) MetaboLights (MTBLS1925) Strain: PANC-1 cell [BCGO:0000122]
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Trp-Thr-Gly-Cys (CHEBI:180574) is a tetrapeptide (CHEBI:48030)
IUPAC Name 
2-[[2-[[2-[[2-amino-3-(1H-indol-3-yl)propanoyl]amino]-3-hydroxybutanoyl]amino]acetyl]amino]-3-sulanylpropanoic acid
Manual XrefsDatabases
16718234ChemSpider