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CHEBI:108772 - 1-[[(2S,3R)-10-(dimethylamino)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-2-yl]methyl]-1-methyl-3-(1-naphthalenyl)urea

ChEBI IDCHEBI:108772
ChEBI Name1-[[(2S,3R)-10-(dimethylamino)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-2-yl]methyl]-1-methyl-3-(1-naphthalenyl)urea
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DownloadsMolfile
FormulaC29H36N4O4
Net Charge0
Average Mass504.631
Monoisotopic Mass504.27366
SMILESC[C@@H]1CN([C@@H](C)CO)C(=O)c2cccc(N(C)C)c2O[C@@H]1CN(C)C(=O)Nc1cccc2ccccc12
InChIInChI=1S/C29H36N4O4/c1-19-16-33(20(2)18-34)28(35)23-13-9-15-25(31(3)4)27(23)37-26(19)17-32(5)29(36)30-24-14-8-11-21-10-6-7-12-22(21)24/h6-15,19-20,26,34H,16-18H2,1-5H3,(H,30,36)/t19-,20+,26-/m1/s1
InChIKeyQINKYHPKCUNNMN-BVFVYWQFSA-N
ChEBI Ontology
Outgoing Relation(s)
1-[[(2S,3R)-10-(dimethylamino)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-2-yl]methyl]-1-methyl-3-(1-naphthalenyl)urea (CHEBI:108772) is a naphthalenes (CHEBI:25477)
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