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CHEBI:126157 - N-[(2R,3R)-2-[[(3,4-dichlorophenyl)methyl-methylamino]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:126157
ChEBI NameN-[(2R,3R)-2-[[(3,4-dichlorophenyl)methyl-methylamino]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
FormulaC30H34Cl2N4O4
Net Charge0
Average Mass585.532
Monoisotopic Mass584.19571
SMILESC[C@@H]1CN([C@@H](C)CO)C(=O)Cc2cc(NC(=O)c3ccncc3)ccc2O[C@H]1CN(C)Cc1ccc(Cl)c(Cl)c1
InChIInChI=1S/C30H34Cl2N4O4/c1-19-15-36(20(2)18-37)29(38)14-23-13-24(34-30(39)22-8-10-33-11-9-22)5-7-27(23)40-28(19)17-35(3)16-21-4-6-25(31)26(32)12-21/h4-13,19-20,28,37H,14-18H2,1-3H3,(H,34,39)/t19-,20+,28+/m1/s1
InChIKeySPNWIHHPPMUGLU-HNPLUWAHSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(2R,3R)-2-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-pyridinecarboxamide (CHEBI:126157) is a pyridinecarboxamide (CHEBI:25529)
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