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CHEBI:94925 - N-[(2S,3R)-2-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]cyclopropanecarboxamide

ChEBI IDCHEBI:94925
ChEBI NameN-[(2S,3R)-2-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]cyclopropanecarboxamide
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DownloadsMolfile
FormulaC27H33Cl2N3O4
Net Charge0
Average Mass534.484
Monoisotopic Mass533.18481
SMILESC[C@@H]1CN([C@H](C)CO)C(=O)c2cccc(NC(=O)C3CC3)c2O[C@@H]1CN(C)Cc1ccc(Cl)c(Cl)c1
InChIInChI=1S/C27H33Cl2N3O4/c1-16-12-32(17(2)15-33)27(35)20-5-4-6-23(30-26(34)19-8-9-19)25(20)36-24(16)14-31(3)13-18-7-10-21(28)22(29)11-18/h4-7,10-11,16-17,19,24,33H,8-9,12-15H2,1-3H3,(H,30,34)/t16-,17-,24-/m1/s1
InChIKeyMNMLFFQUHHOZKL-HOZJOUCCSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(2S,3R)-2-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]cyclopropanecarboxamide (CHEBI:94925) is a dichlorobenzene (CHEBI:23697)
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