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CHEBI:124427 - N-[(2R,3S)-2-[[[(4-fluoroanilino)-oxomethyl]-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]cyclopropanecarboxamide

ChEBI IDCHEBI:124427
ChEBI NameN-[(2R,3S)-2-[[[(4-fluoroanilino)-oxomethyl]-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]cyclopropanecarboxamide
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DownloadsMolfile
FormulaC27H33FN4O5
Net Charge0
Average Mass512.582
Monoisotopic Mass512.24350
SMILESC[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccc(F)cc2)Oc2c(NC(=O)C3CC3)cccc2C1=O
InChIInChI=1S/C27H33FN4O5/c1-16-13-32(17(2)15-33)26(35)21-5-4-6-22(30-25(34)18-7-8-18)24(21)37-23(16)14-31(3)27(36)29-20-11-9-19(28)10-12-20/h4-6,9-12,16-18,23,33H,7-8,13-15H2,1-3H3,(H,29,36)(H,30,34)/t16-,17+,23-/m0/s1
InChIKeyAAAGYPLVPQGIIN-MFEFFIJZSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(2R,3S)-2-[[[(4-fluoroanilino)-oxomethyl]-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]cyclopropanecarboxamide (CHEBI:124427) is a ureas (CHEBI:47857)
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