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CHEBI:124228 - 1-(1,3-benzodioxol-5-yl)-3-[(2S,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]urea

ChEBI IDCHEBI:124228
ChEBI Name1-(1,3-benzodioxol-5-yl)-3-[(2S,3S)-5-[(2R)-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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DownloadsMolfile
FormulaC25H32N4O6
Net Charge0
Average Mass484.553
Monoisotopic Mass484.23218
SMILESCNC[C@H]1Oc2ccc(NC(=O)Nc3ccc4c(c3)OCO4)cc2CC(=O)N([C@H](C)CO)C[C@@H]1C
InChIInChI=1S/C25H32N4O6/c1-15-12-29(16(2)13-30)24(31)9-17-8-18(4-6-20(17)35-23(15)11-26-3)27-25(32)28-19-5-7-21-22(10-19)34-14-33-21/h4-8,10,15-16,23,26,30H,9,11-14H2,1-3H3,(H2,27,28,32)/t15-,16+,23+/m0/s1
InChIKeyBRYKRAAGJVMQDR-NXHTTZLHSA-N
ChEBI Ontology
Outgoing Relation(s)
1-(1,3-benzodioxol-5-yl)-3-[(2S,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]urea (CHEBI:124228) is a benzodioxoles (CHEBI:38298)
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