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CHEBI:111770 - N-[[(2S,3R)-10-(dimethylamino)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-2-yl]methyl]-N,4-dimethylbenzenesulfonamide

ChEBI IDCHEBI:111770
ChEBI NameN-[[(2S,3R)-10-(dimethylamino)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-2-yl]methyl]-N,4-dimethylbenzenesulfonamide
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DownloadsMolfile
FormulaC25H35N3O5S
Net Charge0
Average Mass489.638
Monoisotopic Mass489.22974
SMILESCc1ccc(S(=O)(=O)N(C)C[C@H]2Oc3c(cccc3N(C)C)C(=O)N([C@H](C)CO)C[C@H]2C)cc1
InChIInChI=1S/C25H35N3O5S/c1-17-10-12-20(13-11-17)34(31,32)27(6)15-23-18(2)14-28(19(3)16-29)25(30)21-8-7-9-22(26(4)5)24(21)33-23/h7-13,18-19,23,29H,14-16H2,1-6H3/t18-,19-,23-/m1/s1
InChIKeyANXKOFDVDMSSFK-DNVFCKCGSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[[(2S,3R)-10-(dimethylamino)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-2-yl]methyl]-N,4-dimethylbenzenesulfonamide (CHEBI:111770) is a sulfonamide (CHEBI:35358)
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