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CHEBI:124100 - 1-[[(2R,3R)-5-[(2R)-1-hydroxypropan-2-yl]-8-(methanesulfonamido)-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-2-yl]methyl]-1-methyl-3-propan-2-ylurea

ChEBI IDCHEBI:124100
ChEBI Name1-[[(2R,3R)-5-[(2R)-1-hydroxypropan-2-yl]-8-(methanesulfonamido)-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-2-yl]methyl]-1-methyl-3-propan-2-ylurea
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DownloadsMolfile
FormulaC21H34N4O6S
Net Charge0
Average Mass470.592
Monoisotopic Mass470.21991
SMILESCC(C)NC(=O)N(C)C[C@@H]1Oc2ccc(NS(C)(=O)=O)cc2C(=O)N([C@H](C)CO)C[C@H]1C
InChIInChI=1S/C21H34N4O6S/c1-13(2)22-21(28)24(5)11-19-14(3)10-25(15(4)12-26)20(27)17-9-16(23-32(6,29)30)7-8-18(17)31-19/h7-9,13-15,19,23,26H,10-12H2,1-6H3,(H,22,28)/t14-,15-,19+/m1/s1
InChIKeyWMQLAFPHYMXYRJ-CLCXKQKWSA-N
ChEBI Ontology
Outgoing Relation(s)
1-[[(2R,3R)-5-[(2R)-1-hydroxypropan-2-yl]-8-(methanesulfonamido)-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-2-yl]methyl]-1-methyl-3-propan-2-ylurea (CHEBI:124100) is a sulfonamide (CHEBI:35358)
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