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CHEBI:123798 - N-[(2S,3R)-2-[[cyclohexylmethyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-1-methyl-4-imidazolesulfonamide

ChEBI IDCHEBI:123798
ChEBI NameN-[(2S,3R)-2-[[cyclohexylmethyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-1-methyl-4-imidazolesulfonamide
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DownloadsMolfile
FormulaC27H41N5O5S
Net Charge0
Average Mass547.722
Monoisotopic Mass547.28284
SMILESC[C@@H]1CN([C@H](C)CO)C(=O)c2cccc(NS(=O)(=O)c3cn(C)cn3)c2O[C@@H]1CN(C)CC1CCCCC1
InChIInChI=1S/C27H41N5O5S/c1-19-13-32(20(2)17-33)27(34)22-11-8-12-23(29-38(35,36)25-16-31(4)18-28-25)26(22)37-24(19)15-30(3)14-21-9-6-5-7-10-21/h8,11-12,16,18-21,24,29,33H,5-7,9-10,13-15,17H2,1-4H3/t19-,20-,24-/m1/s1
InChIKeyOIUJMOWVUMHDSM-YOSAUDMPSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(2S,3R)-2-[[cyclohexylmethyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-1-methyl-4-imidazolesulfonamide (CHEBI:123798) is a sulfonamide (CHEBI:35358)
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LSM-35240LINCS