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CHEBI:130861 - 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]-2-(1-methyl-3-indolyl)acetamide

ChEBI IDCHEBI:130861
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]-2-(1-methyl-3-indolyl)acetamide
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DownloadsMolfile
FormulaC35H40Cl2N4O4
Net Charge0
Average Mass651.635
Monoisotopic Mass650.24266
SMILESC[C@@H]1CN([C@@H](C)CO)C(=O)Cc2cc(NC(=O)Cc3cn(C)c4ccccc34)ccc2O[C@H]1CN(C)Cc1ccc(Cl)c(Cl)c1
InChIInChI=1S/C35H40Cl2N4O4/c1-22-17-41(23(2)21-42)35(44)16-25-14-27(38-34(43)15-26-19-40(4)31-8-6-5-7-28(26)31)10-12-32(25)45-33(22)20-39(3)18-24-9-11-29(36)30(37)13-24/h5-14,19,22-23,33,42H,15-18,20-21H2,1-4H3,(H,38,43)/t22-,23+,33+/m1/s1
InChIKeyHTBVGGFTFZKUKZ-QYUJLGCLSA-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]-2-(1-methyl-3-indolyl)acetamide (CHEBI:130861) is a indoles (CHEBI:24828)
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