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CHEBI:124188 - 1-[(2S,3S)-2-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-(3,5-dimethyl-4-isoxazolyl)urea

ChEBI IDCHEBI:124188
ChEBI Name1-[(2S,3S)-2-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-(3,5-dimethyl-4-isoxazolyl)urea
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DownloadsMolfile
FormulaC29H35Cl2N5O5
Net Charge0
Average Mass604.535
Monoisotopic Mass603.20152
SMILESCc1noc(C)c1NC(=O)Nc1ccc2c(c1)C(=O)N([C@H](C)CO)C[C@H](C)[C@@H](CN(C)Cc1ccc(Cl)c(Cl)c1)O2
InChIInChI=1S/C29H35Cl2N5O5/c1-16-12-36(17(2)15-37)28(38)22-11-21(32-29(39)33-27-18(3)34-41-19(27)4)7-9-25(22)40-26(16)14-35(5)13-20-6-8-23(30)24(31)10-20/h6-11,16-17,26,37H,12-15H2,1-5H3,(H2,32,33,39)/t16-,17+,26+/m0/s1
InChIKeyWFBFGDCPYFNMAV-PAPQREIWSA-N
ChEBI Ontology
Outgoing Relation(s)
1-[(2S,3S)-2-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-(3,5-dimethyl-4-isoxazolyl)urea (CHEBI:124188) is a dichlorobenzene (CHEBI:23697)
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