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CHEBI:129903 - (6R,7R,8S)-7-[4-[3-(dimethylamino)prop-1-ynyl]phenyl]-4-[(4-fluorophenyl)-oxomethyl]-8-(hydroxymethyl)-1,4-diazabicyclo[4.2.0]octan-2-one

ChEBI IDCHEBI:129903
ChEBI Name(6R,7R,8S)-7-[4-[3-(dimethylamino)prop-1-ynyl]phenyl]-4-[(4-fluorophenyl)-oxomethyl]-8-(hydroxymethyl)-1,4-diazabicyclo[4.2.0]octan-2-one
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DownloadsMolfile
FormulaC25H26FN3O3
Net Charge0
Average Mass435.499
Monoisotopic Mass435.19582
SMILESCN(C)CC#Cc1ccc([C@H]2[C@@H](CO)N3C(=O)CN(C(=O)c4ccc(F)cc4)C[C@@H]23)cc1
InChIInChI=1S/C25H26FN3O3/c1-27(2)13-3-4-17-5-7-18(8-6-17)24-21-14-28(15-23(31)29(21)22(24)16-30)25(32)19-9-11-20(26)12-10-19/h5-12,21-22,24,30H,13-16H2,1-2H3/t21-,22+,24+/m0/s1
InChIKeyHABPCLIMXOARHP-WMTXJRDZSA-N
ChEBI Ontology
Outgoing Relation(s)
(6R,7R,8S)-7-[4-[3-(dimethylamino)prop-1-ynyl]phenyl]-4-[(4-fluorophenyl)-oxomethyl]-8-(hydroxymethyl)-1,4-diazabicyclo[4.2.0]octan-2-one (CHEBI:129903) is a azetidines (CHEBI:38777)
(6R,7R,8S)-7-[4-[3-(dimethylamino)prop-1-ynyl]phenyl]-4-[(4-fluorophenyl)-oxomethyl]-8-(hydroxymethyl)-1,4-diazabicyclo[4.2.0]octan-2-one (CHEBI:129903) is a benzenes (CHEBI:22712)
(6R,7R,8S)-7-[4-[3-(dimethylamino)prop-1-ynyl]phenyl]-4-[(4-fluorophenyl)-oxomethyl]-8-(hydroxymethyl)-1,4-diazabicyclo[4.2.0]octan-2-one (CHEBI:129903) is a ring assembly (CHEBI:36820)
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