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CHEBI:115018 - 2-[[[4-[[5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]pentylamino]-oxomethyl]-1H-imidazol-5-yl]-oxomethyl]amino]acetic acid tert-butyl ester

ChEBI IDCHEBI:115018
ChEBI Name2-[[[4-[[5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]pentylamino]-oxomethyl]-1H-imidazol-5-yl]-oxomethyl]amino]acetic acid tert-butyl ester
Stars
Last Modified9 March 2018
DownloadsMolfile
FormulaC21H35N5O6
Net Charge0
Average Mass453.540
Monoisotopic Mass453.25873
SMILESCC(C)(C)OC(=O)CNC(=O)c1ncnc1C(=O)NCCCCCNC(=O)OC(C)(C)C
InChIInChI=1S/C21H35N5O6/c1-20(2,3)31-14(27)12-24-18(29)16-15(25-13-26-16)17(28)22-10-8-7-9-11-23-19(30)32-21(4,5)6/h13H,7-12H2,1-6H3,(H,22,28)(H,23,30)(H,24,29)(H,25,26)
InChIKeyKCVHFGFPHUIUFI-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
2-[[[4-[[5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]pentylamino]-oxomethyl]-1H-imidazol-5-yl]-oxomethyl]amino]acetic acid tert-butyl ester (CHEBI:115018) is a N-acyl-amino acid (CHEBI:51569)
2-[[[4-[[5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]pentylamino]-oxomethyl]-1H-imidazol-5-yl]-oxomethyl]amino]acetic acid tert-butyl ester (CHEBI:115018) is a tert-butyl ester (CHEBI:140402)
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