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CHEBI:149915 - Benzyl N-[(2S)-1-[[6-(dimethylamino)-1-fluoro-2,6-dioxohexan-3-yl]amino]-3-methyl-1-oxobutan-2-yl]carbamate

ChEBI IDCHEBI:149915
ChEBI NameBenzyl N-[(2S)-1-[[6-(dimethylamino)-1-fluoro-2,6-dioxohexan-3-yl]amino]-3-methyl-1-oxobutan-2-yl]carbamate
Stars
DownloadsMolfile
FormulaC21H30FN3O5
Net Charge0
Average Mass423.485
Monoisotopic Mass423.21695
SMILESCC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC(CCC(=O)N(C)C)C(=O)CF
InChIInChI=1S/C21H30FN3O5/c1-14(2)19(24-21(29)30-13-15-8-6-5-7-9-15)20(28)23-16(17(26)12-22)10-11-18(27)25(3)4/h5-9,14,16,19H,10-13H2,1-4H3,(H,23,28)(H,24,29)/t16?,19-/m0/s1
InChIKeyCAZMERAZKBCKSZ-CVMIBEPCSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Role:
anticoronaviral agent  Any antiviral agent which inhibits the activity of coronaviruses.
ChEBI Ontology
Outgoing Relation(s)
Benzyl N-[(2S)-1-[[6-(dimethylamino)-1-fluoro-2,6-dioxohexan-3-yl]amino]-3-methyl-1-oxobutan-2-yl]carbamate (CHEBI:149915) has role anticoronaviral agent (CHEBI:149553)
Benzyl N-[(2S)-1-[[6-(dimethylamino)-1-fluoro-2,6-dioxohexan-3-yl]amino]-3-methyl-1-oxobutan-2-yl]carbamate (CHEBI:149915) is a peptide (CHEBI:16670)