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CHEBI:131225 - 2-[(2R,4aS,12aS)-8-[(4-chlorophenyl)sulfonylamino]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]-N-(1,3-dihydroisobenzofuran-5-yl)acetamide

ChEBI IDCHEBI:131225
ChEBI Name2-[(2R,4aS,12aS)-8-[(4-chlorophenyl)sulfonylamino]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]-N-(1,3-dihydroisobenzofuran-5-yl)acetamide
Stars
DownloadsMolfile
FormulaC30H30ClN3O7S
Net Charge0
Average Mass612.104
Monoisotopic Mass611.14930
SMILESCN1C(=O)c2cc(NS(=O)(=O)c3ccc(Cl)cc3)ccc2OC[C@H]2O[C@@H](CC(=O)Nc3ccc4c(c3)COC4)CC[C@@H]21
InChIInChI=1S/C30H30ClN3O7S/c1-34-26-10-7-23(14-29(35)32-21-5-2-18-15-39-16-19(18)12-21)41-28(26)17-40-27-11-6-22(13-25(27)30(34)36)33-42(37,38)24-8-3-20(31)4-9-24/h2-6,8-9,11-13,23,26,28,33H,7,10,14-17H2,1H3,(H,32,35)/t23-,26+,28-/m1/s1
InChIKeyQXDICPGBMSBLQM-RXWNPYQGSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[(2R,4aS,12aS)-8-[(4-chlorophenyl)sulfonylamino]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]-N-(1,3-dihydroisobenzofuran-5-yl)acetamide (CHEBI:131225) is a sulfonamide (CHEBI:35358)
Manual XrefsDatabases
LSM-13719LINCS