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CHEBI:124508 - 1-(3,5-dimethyl-4-isoxazolyl)-3-[(2R,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]urea

ChEBI IDCHEBI:124508
ChEBI Name1-(3,5-dimethyl-4-isoxazolyl)-3-[(2R,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]urea
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FormulaC23H33N5O5
Net Charge0
Average Mass459.547
Monoisotopic Mass459.24817
SMILESCNC[C@@H]1Oc2ccc(NC(=O)Nc3c(C)noc3C)cc2CC(=O)N([C@@H](C)CO)C[C@H]1C
InChIInChI=1S/C23H33N5O5/c1-13-11-28(14(2)12-29)21(30)9-17-8-18(6-7-19(17)32-20(13)10-24-5)25-23(31)26-22-15(3)27-33-16(22)4/h6-8,13-14,20,24,29H,9-12H2,1-5H3,(H2,25,26,31)/t13-,14+,20+/m1/s1
InChIKeyGJSCVGWEXUPFQW-CKNLXJGOSA-N
ChEBI Ontology
Outgoing Relation(s)
1-(3,5-dimethyl-4-isoxazolyl)-3-[(2R,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]urea (CHEBI:124508) is a aromatic ether (CHEBI:35618)
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