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CHEBI:126687 - N-[[(4S,5R)-8-(1-cyclopentenyl)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methylcyclobutanecarboxamide

ChEBI IDCHEBI:126687
ChEBI NameN-[[(4S,5R)-8-(1-cyclopentenyl)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methylcyclobutanecarboxamide
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FormulaC25H36N2O5S
Net Charge0
Average Mass476.639
Monoisotopic Mass476.23449
SMILESC[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCC2)Oc2cc(C3=CCCC3)ccc2S1(=O)=O
InChIInChI=1S/C25H36N2O5S/c1-17-14-27(18(2)16-28)33(30,31)24-12-11-21(19-7-4-5-8-19)13-22(24)32-23(17)15-26(3)25(29)20-9-6-10-20/h7,11-13,17-18,20,23,28H,4-6,8-10,14-16H2,1-3H3/t17-,18+,23-/m0/s1
InChIKeyOORKZMYQCAZRNE-IXFSTUDKSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[[(4S,5R)-8-(1-cyclopentenyl)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methylcyclobutanecarboxamide (CHEBI:126687) is a aromatic ether (CHEBI:35618)
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