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CHEBI:113760 - N-[(2R,3R)-2-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-2-(1-tetrazolyl)acetamide

ChEBI IDCHEBI:113760
ChEBI NameN-[(2R,3R)-2-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-2-(1-tetrazolyl)acetamide
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DownloadsMolfile
FormulaC26H31Cl2N7O4
Net Charge0
Average Mass576.485
Monoisotopic Mass575.18146
SMILESC[C@@H]1CN([C@@H](C)CO)C(=O)c2cc(NC(=O)Cn3cnnn3)ccc2O[C@H]1CN(C)Cc1ccc(Cl)c(Cl)c1
InChIInChI=1S/C26H31Cl2N7O4/c1-16-10-35(17(2)14-36)26(38)20-9-19(30-25(37)13-34-15-29-31-32-34)5-7-23(20)39-24(16)12-33(3)11-18-4-6-21(27)22(28)8-18/h4-9,15-17,24,36H,10-14H2,1-3H3,(H,30,37)/t16-,17+,24+/m1/s1
InChIKeyMIRHJXKFLNBQHA-KCYKTTMJSA-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-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-2-(1-tetrazolyl)acetamide (CHEBI:113760) is a dichlorobenzene (CHEBI:23697)
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