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CHEBI:124728 - 1-cyclohexyl-3-[(2S,3S)-2-[[cyclohexylmethyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]urea

ChEBI IDCHEBI:124728
ChEBI Name1-cyclohexyl-3-[(2S,3S)-2-[[cyclohexylmethyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]urea
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DownloadsMolfile
FormulaC31H50N4O4
Net Charge0
Average Mass542.765
Monoisotopic Mass542.38321
SMILESC[C@H](CO)N1C[C@H](C)[C@@H](CN(C)CC2CCCCC2)Oc2ccc(NC(=O)NC3CCCCC3)cc2CC1=O
InChIInChI=1S/C31H50N4O4/c1-22-18-35(23(2)21-36)30(37)17-25-16-27(33-31(38)32-26-12-8-5-9-13-26)14-15-28(25)39-29(22)20-34(3)19-24-10-6-4-7-11-24/h14-16,22-24,26,29,36H,4-13,17-21H2,1-3H3,(H2,32,33,38)/t22-,23+,29+/m0/s1
InChIKeyJQDBFISYHKVRFB-QFWOEDSFSA-N
ChEBI Ontology
Outgoing Relation(s)
1-cyclohexyl-3-[(2S,3S)-2-[[cyclohexylmethyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]urea (CHEBI:124728) is a aromatic ether (CHEBI:35618)
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