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CHEBI:130086 - 2-[(3R,6aR,8R,10aR)-3-hydroxy-1-[[4-(trifluoromethyl)phenyl]methyl]-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(1R)-1-phenylethyl]acetamide

ChEBI IDCHEBI:130086
ChEBI Name2-[(3R,6aR,8R,10aR)-3-hydroxy-1-[[4-(trifluoromethyl)phenyl]methyl]-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(1R)-1-phenylethyl]acetamide
Stars
DownloadsMolfile
FormulaC27H33F3N2O4
Net Charge0
Average Mass506.565
Monoisotopic Mass506.23924
SMILESC[C@@H](NC(=O)C[C@H]1CC[C@@H]2[C@H](COC[C@H](O)CN2Cc2ccc(C(F)(F)F)cc2)O1)c1ccccc1
InChIInChI=1S/C27H33F3N2O4/c1-18(20-5-3-2-4-6-20)31-26(34)13-23-11-12-24-25(36-23)17-35-16-22(33)15-32(24)14-19-7-9-21(10-8-19)27(28,29)30/h2-10,18,22-25,33H,11-17H2,1H3,(H,31,34)/t18-,22-,23-,24-,25+/m1/s1
InChIKeyJNSFRWOELQVFNZ-BQJLFWIDSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[(3R,6aR,8R,10aR)-3-hydroxy-1-[[4-(trifluoromethyl)phenyl]methyl]-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(1R)-1-phenylethyl]acetamide (CHEBI:130086) is a (trifluoromethyl)benzenes (CHEBI:83565)
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