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CHEBI:130208 - N-[[(4R,5S)-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-methylbenzamide

Default Structure
ChEBI IDCHEBI:130208
ChEBI NameN-[[(4R,5S)-8-(1-cyclopentenyl)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methylbenzamide
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DownloadsMolfile
FormulaC27H34N2O5S
Net Charge0
Average Mass498.645
Monoisotopic Mass498.21884
SMILESC[C@@H]1CN([C@H](C)CO)S(=O)(=O)c2ccc(C3=CCCC3)cc2O[C@@H]1CN(C)C(=O)c1ccccc1
InChIInChI=1S/C27H34N2O5S/c1-19-16-29(20(2)18-30)35(32,33)26-14-13-23(21-9-7-8-10-21)15-24(26)34-25(19)17-28(3)27(31)22-11-5-4-6-12-22/h4-6,9,11-15,19-20,25,30H,7-8,10,16-18H2,1-3H3/t19-,20-,25-/m1/s1
InChIKeyUFCPYRWCPDLGEX-UMEGOILYSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[[(4R,5S)-8-(1-cyclopentenyl)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methylbenzamide (CHEBI:130208) is a benzamides (CHEBI:22702)
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