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CHEBI:230096 - Tyrosyl-prolyl-leucyl-glycinamide

Default Structure
ChEBI IDCHEBI:230096
ChEBI NameTyrosyl-prolyl-leucyl-glycinamide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H33N5O5
Net Charge0
Average Mass447.536
Monoisotopic Mass447.24817
SMILESCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(N)=O
InChIInChI=1S/C22H33N5O5/c1-2-3-5-17(20(30)25-13-19(24)29)26-21(31)18-6-4-11-27(18)22(32)16(23)12-14-7-9-15(28)10-8-14/h7-10,16-18,28H,2-6,11-13,23H2,1H3,(H2,24,29)(H,25,30)(H,26,31)/t16-,17-,18-/m0/s1
InChIKeySEAGUNDLDLZLLQ-BZSNNMDCSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS9100)
ChEBI Ontology
Outgoing Relation(s)
Tyrosyl-prolyl-leucyl-glycinamide (CHEBI:230096) is a organic molecular entity (CHEBI:50860)
IUPAC Name 
(2S)-1-[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]-N-[(2S)-1-[(2-amino-2-oxoethyl)amino]-1-oxohexan-2-yl]pyrrolidine-2-carboxamide
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102988ChemSpider