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CHEBI:111795 - N-[(2S,3R)-2-[[cyclohexylmethyl(methyl)amino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3,5-dimethyl-4-isoxazolesulfonamide

ChEBI IDCHEBI:111795
ChEBI NameN-[(2S,3R)-2-[[cyclohexylmethyl(methyl)amino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3,5-dimethyl-4-isoxazolesulfonamide
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DownloadsMolfile
FormulaC29H44N4O6S
Net Charge0
Average Mass576.760
Monoisotopic Mass576.29816
SMILESCc1noc(C)c1S(=O)(=O)Nc1ccc2c(c1)CC(=O)N([C@@H](C)CO)C[C@@H](C)[C@@H](CN(C)CC1CCCCC1)O2
InChIInChI=1S/C29H44N4O6S/c1-19-15-33(20(2)18-34)28(35)14-24-13-25(31-40(36,37)29-21(3)30-39-22(29)4)11-12-26(24)38-27(19)17-32(5)16-23-9-7-6-8-10-23/h11-13,19-20,23,27,31,34H,6-10,14-18H2,1-5H3/t19-,20+,27-/m1/s1
InChIKeyFITMUQCJUCLPTO-IOKPGSKQSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(2S,3R)-2-[[cyclohexylmethyl(methyl)amino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3,5-dimethyl-4-isoxazolesulfonamide (CHEBI:111795) is a sulfonamide (CHEBI:35358)
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