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CHEBI:97054 - N-[(2R,4aR,12aR)-5-methyl-2-[2-(methylamino)-2-oxoethyl]-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-3,5-difluorobenzamide

ChEBI IDCHEBI:97054
ChEBI NameN-[(2R,4aR,12aR)-5-methyl-2-[2-(methylamino)-2-oxoethyl]-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-3,5-difluorobenzamide
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DownloadsMolfile
FormulaC24H25F2N3O5
Net Charge0
Average Mass473.476
Monoisotopic Mass473.17623
SMILESCNC(=O)C[C@H]1CC[C@@H]2[C@H](COc3ccc(NC(=O)c4cc(F)cc(F)c4)cc3C(=O)N2C)O1
InChIInChI=1S/C24H25F2N3O5/c1-27-22(30)11-17-4-5-19-21(34-17)12-33-20-6-3-16(10-18(20)24(32)29(19)2)28-23(31)13-7-14(25)9-15(26)8-13/h3,6-10,17,19,21H,4-5,11-12H2,1-2H3,(H,27,30)(H,28,31)/t17-,19-,21+/m1/s1
InChIKeyRQAOUBOGQGVTCU-QFUCXCTJSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(2R,4aR,12aR)-5-methyl-2-[2-(methylamino)-2-oxoethyl]-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-3,5-difluorobenzamide (CHEBI:97054) is a carbonyl compound (CHEBI:36586)
N-[(2R,4aR,12aR)-5-methyl-2-[2-(methylamino)-2-oxoethyl]-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-3,5-difluorobenzamide (CHEBI:97054) is a organohalogen compound (CHEBI:17792)
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