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CHEBI:124640 - N-[(2S,3S)-2-[[1,3-benzodioxol-5-ylmethyl(methyl)amino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-pyridinecarboxamide

ChEBI IDCHEBI:124640
ChEBI NameN-[(2S,3S)-2-[[1,3-benzodioxol-5-ylmethyl(methyl)amino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-pyridinecarboxamide
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DownloadsMolfile
FormulaC31H36N4O6
Net Charge0
Average Mass560.651
Monoisotopic Mass560.26348
SMILESC[C@H]1CN([C@@H](C)CO)C(=O)Cc2cc(NC(=O)c3ccncc3)ccc2O[C@@H]1CN(C)Cc1ccc2c(c1)OCO2
InChIInChI=1S/C31H36N4O6/c1-20-15-35(21(2)18-36)30(37)14-24-13-25(33-31(38)23-8-10-32-11-9-23)5-7-26(24)41-29(20)17-34(3)16-22-4-6-27-28(12-22)40-19-39-27/h4-13,20-21,29,36H,14-19H2,1-3H3,(H,33,38)/t20-,21-,29+/m0/s1
InChIKeyGOLGPKZUGFBYOC-LRZFZUCMSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(2S,3S)-2-[[1,3-benzodioxol-5-ylmethyl(methyl)amino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-pyridinecarboxamide (CHEBI:124640) is a benzodioxoles (CHEBI:38298)
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