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CHEBI:131128 - 2-[(3R,6aR,8S,10aR)-1-[(4-fluorophenyl)-oxomethyl]-3-hydroxy-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-(4-phenylphenyl)acetamide

ChEBI IDCHEBI:131128
ChEBI Name2-[(3R,6aR,8S,10aR)-1-[(4-fluorophenyl)-oxomethyl]-3-hydroxy-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-(4-phenylphenyl)acetamide
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DownloadsMolfile
FormulaC30H31FN2O5
Net Charge0
Average Mass518.585
Monoisotopic Mass518.22170
SMILESO=C(C[C@@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2C(=O)c2ccc(F)cc2)O1)Nc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C30H31FN2O5/c31-23-10-6-22(7-11-23)30(36)33-17-25(34)18-37-19-28-27(33)15-14-26(38-28)16-29(35)32-24-12-8-21(9-13-24)20-4-2-1-3-5-20/h1-13,25-28,34H,14-19H2,(H,32,35)/t25-,26+,27-,28+/m1/s1
InChIKeyJNKWEQJKKHEMOT-GCFVYEKYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[(3R,6aR,8S,10aR)-1-[(4-fluorophenyl)-oxomethyl]-3-hydroxy-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-(4-phenylphenyl)acetamide (CHEBI:131128) is a biphenyls (CHEBI:22888)
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