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CHEBI:131013 - 2-[(3R,6aS,8S,10aS)-3-hydroxy-1-[(4-phenoxyphenyl)methyl]-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-1-(4-morpholinyl)ethanone

ChEBI IDCHEBI:131013
ChEBI Name2-[(3R,6aS,8S,10aS)-3-hydroxy-1-[(4-phenoxyphenyl)methyl]-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-1-(4-morpholinyl)ethanone
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DownloadsMolfile
FormulaC28H36N2O6
Net Charge0
Average Mass496.604
Monoisotopic Mass496.25734
SMILESO=C(C[C@@H]1CC[C@H]2[C@@H](COC[C@H](O)CN2Cc2ccc(Oc3ccccc3)cc2)O1)N1CCOCC1
InChIInChI=1S/C28H36N2O6/c31-22-18-30(17-21-6-8-24(9-7-21)35-23-4-2-1-3-5-23)26-11-10-25(36-27(26)20-34-19-22)16-28(32)29-12-14-33-15-13-29/h1-9,22,25-27,31H,10-20H2/t22-,25+,26+,27-/m1/s1
InChIKeyMHHGGSJJSYEMDJ-LHIMOPHOSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[(3R,6aS,8S,10aS)-3-hydroxy-1-[(4-phenoxyphenyl)methyl]-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-1-(4-morpholinyl)ethanone (CHEBI:131013) is a aromatic ether (CHEBI:35618)
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