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CHEBI:94871 - 3-cyclohexyl-1-[[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-10-[(4-methoxyphenyl)sulfonylamino]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-2-yl]methyl]-1-methylurea

ChEBI IDCHEBI:94871
ChEBI Name3-cyclohexyl-1-[[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-10-[(4-methoxyphenyl)sulfonylamino]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-2-yl]methyl]-1-methylurea
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FormulaC30H42N4O7S
Net Charge0
Average Mass602.754
Monoisotopic Mass602.27742
SMILESCOc1ccc(S(=O)(=O)Nc2cccc3c2O[C@@H](CN(C)C(=O)NC2CCCCC2)[C@@H](C)CN([C@H](C)CO)C3=O)cc1
InChIInChI=1S/C30H42N4O7S/c1-20-17-34(21(2)19-35)29(36)25-11-8-12-26(32-42(38,39)24-15-13-23(40-4)14-16-24)28(25)41-27(20)18-33(3)30(37)31-22-9-6-5-7-10-22/h8,11-16,20-22,27,32,35H,5-7,9-10,17-19H2,1-4H3,(H,31,37)/t20-,21+,27-/m0/s1
InChIKeyBOEAWUHMOQSHIW-ISCCLHIJSA-N
ChEBI Ontology
Outgoing Relation(s)
3-cyclohexyl-1-[[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-10-[(4-methoxyphenyl)sulfonylamino]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-2-yl]methyl]-1-methylurea (CHEBI:94871) is a sulfonamide (CHEBI:35358)
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