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CHEBI:130956 - 1-[[(2R,3R)-5-[(2R)-1-hydroxypropan-2-yl]-9-[[(4-methoxyanilino)-oxomethyl]amino]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-2-yl]methyl]-3-(4-methoxyphenyl)-1-methylurea

ChEBI IDCHEBI:130956
ChEBI Name1-[[(2R,3R)-5-[(2R)-1-hydroxypropan-2-yl]-9-[[(4-methoxyanilino)-oxomethyl]amino]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-2-yl]methyl]-3-(4-methoxyphenyl)-1-methylurea
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DownloadsMolfile
FormulaC33H41N5O7
Net Charge0
Average Mass619.719
Monoisotopic Mass619.30060
SMILESCOc1ccc(NC(=O)Nc2ccc3c(c2)CC(=O)N([C@H](C)CO)C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(OC)cc2)O3)cc1
InChIInChI=1S/C33H41N5O7/c1-21-18-38(22(2)20-39)31(40)17-23-16-26(35-32(41)34-24-6-11-27(43-4)12-7-24)10-15-29(23)45-30(21)19-37(3)33(42)36-25-8-13-28(44-5)14-9-25/h6-16,21-22,30,39H,17-20H2,1-5H3,(H,36,42)(H2,34,35,41)/t21-,22-,30+/m1/s1
InChIKeyFDBARYBHBHZYSL-WOGZVKCMSA-N
ChEBI Ontology
Outgoing Relation(s)
1-[[(2R,3R)-5-[(2R)-1-hydroxypropan-2-yl]-9-[[(4-methoxyanilino)-oxomethyl]amino]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-2-yl]methyl]-3-(4-methoxyphenyl)-1-methylurea (CHEBI:130956) is a ureas (CHEBI:47857)
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