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CHEBI:182851 - 2-Amino-5-[[1-[(1-carboxy-2-phenylethyl)amino]-3-methyl-1-oxopentan-2-yl]amino]-5-oxopentanoic acid

ChEBI IDCHEBI:182851
ChEBI Name2-Amino-5-[[1-[(1-carboxy-2-phenylethyl)amino]-3-methyl-1-oxopentan-2-yl]amino]-5-oxopentanoic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H29N3O6
Net Charge0
Average Mass407.467
Monoisotopic Mass407.20564
SMILESCCC(C)C(NC(=O)CCC(N)C(=O)O)C(=O)NC(Cc1ccccc1)C(=O)O
InChIInChI=1S/C20H29N3O6/c1-3-12(2)17(23-16(24)10-9-14(21)19(26)27)18(25)22-15(20(28)29)11-13-7-5-4-6-8-13/h4-8,12,14-15,17H,3,9-11,21H2,1-2H3,(H,22,25)(H,23,24)(H,26,27)(H,28,29)
InChIKeyOAIXARWNIYCAGK-UHFFFAOYSA-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)
2-Amino-5-[[1-[(1-carboxy-2-phenylethyl)amino]-3-methyl-1-oxopentan-2-yl]amino]-5-oxopentanoic acid (CHEBI:182851) is a peptide (CHEBI:16670)
IUPAC Name 
2-amino-5-[[1-[(1-carboxy-2-phenylethyl)amino]-3-methyl-1-oxopentan-2-yl]amino]-5-oxopentanoic acid