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CHEBI:128253 - (6R,7S,8S)-8-(hydroxymethyl)-4-(2-methoxy-1-oxoethyl)-7-[4-(3-methylbut-1-ynyl)phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one

ChEBI IDCHEBI:128253
ChEBI Name(6R,7S,8S)-8-(hydroxymethyl)-4-(2-methoxy-1-oxoethyl)-7-[4-(3-methylbut-1-ynyl)phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one
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DownloadsMolfile
FormulaC21H26N2O4
Net Charge0
Average Mass370.449
Monoisotopic Mass370.18926
SMILESCOCC(=O)N1CC(=O)N2[C@H](CO)[C@@H](c3ccc(C#CC(C)C)cc3)[C@@H]2C1
InChIInChI=1S/C21H26N2O4/c1-14(2)4-5-15-6-8-16(9-7-15)21-17-10-22(20(26)13-27-3)11-19(25)23(17)18(21)12-24/h6-9,14,17-18,21,24H,10-13H2,1-3H3/t17-,18+,21-/m0/s1
InChIKeyFLDRYXIAOMUSHG-UEXGIBASSA-N
ChEBI Ontology
Outgoing Relation(s)
(6R,7S,8S)-8-(hydroxymethyl)-4-(2-methoxy-1-oxoethyl)-7-[4-(3-methylbut-1-ynyl)phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one (CHEBI:128253) is a azetidines (CHEBI:38777)
(6R,7S,8S)-8-(hydroxymethyl)-4-(2-methoxy-1-oxoethyl)-7-[4-(3-methylbut-1-ynyl)phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one (CHEBI:128253) is a benzenes (CHEBI:22712)
(6R,7S,8S)-8-(hydroxymethyl)-4-(2-methoxy-1-oxoethyl)-7-[4-(3-methylbut-1-ynyl)phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one (CHEBI:128253) is a ring assembly (CHEBI:36820)
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