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CHEBI:149934 - Benzyl (2S)-2-[[[(E)-4-(5-chloro-2,4-dioxopyrimidin-1-yl)but-2-enyl]-phenoxyphosphoryl]amino]propanoate

ChEBI IDCHEBI:149934
ChEBI NameBenzyl (2S)-2-[[[(E)-4-(5-chloro-2,4-dioxopyrimidin-1-yl)but-2-enyl]-phenoxyphosphoryl]amino]propanoate
Stars
DownloadsMolfile
FormulaC24H25ClN3O6P
Net Charge0
Average Mass517.906
Monoisotopic Mass517.11695
SMILESC[C@H](NP(=O)(C/C=C/Cn1cc(Cl)c(=O)nc1=O)Oc1ccccc1)C(=O)OCc1ccccc1
InChIInChI=1S/C24H25ClN3O6P/c1-18(23(30)33-17-19-10-4-2-5-11-19)27-35(32,34-20-12-6-3-7-13-20)15-9-8-14-28-16-21(25)22(29)26-24(28)31/h2-13,16,18H,14-15,17H2,1H3,(H,27,32)(H,26,29,31)/b9-8+/t18-,35?/m0/s1
InChIKeyHPFPJPBJRGTRHI-HRRFIACWSA-N
Roles Classification
Biological Role:
anticoronaviral agent  Any antiviral agent which inhibits the activity of coronaviruses.
ChEBI Ontology
Outgoing Relation(s)
Benzyl (2S)-2-[[[(E)-4-(5-chloro-2,4-dioxopyrimidin-1-yl)but-2-enyl]-phenoxyphosphoryl]amino]propanoate (CHEBI:149934) has role anticoronaviral agent (CHEBI:149553)
Benzyl (2S)-2-[[[(E)-4-(5-chloro-2,4-dioxopyrimidin-1-yl)but-2-enyl]-phenoxyphosphoryl]amino]propanoate (CHEBI:149934) is a α-amino acid ester (CHEBI:46874)