CHEBI:124226 - 1-[(2S,3R)-2-[[cyclopropylmethyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3-(3,5-dimethyl-4-isoxazolyl)urea

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ChEBI Name 1-[(2S,3R)-2-[[cyclopropylmethyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3-(3,5-dimethyl-4-isoxazolyl)urea ChEBI ID CHEBI:124226 Stars This entity has been manually annotated by a third party. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C27H39N5O5 Net Charge 0 Average Mass 513.630 Monoisotopic Mass 513.29512 InChI InChI=1S/C27H39N5O5/c1-16-12-32(17(2)15-33)25(34)11-21-10-22(28-27(35)29-26-18(3)30-37-19(26)4)8-9-23(21)36-24(16)14-31(5)13-20-6-7-20/h8-10,16-17,20,24,33H,6-7,11-15H2,1-5H3,(H2,28,29,35)/t16-,17-,24-/m1/s1 InChIKey RRKRQZMEMKUNGW-HOZJOUCCSA-N SMILES C[C@@H]1CN(C(=O)CC2=C(C=CC(=C2)NC(=O)NC3=C(ON=C3C)C)O[C@@H]1CN(C)CC4CC4)[C@H](C)CO ChEBI Ontology Outgoing 1-[(2S,3R)-2-[[cyclopropylmethyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3-(3,5-dimethyl-4-isoxazolyl)urea (CHEBI:124226) is a aromatic ether (CHEBI:35618) Manual Xref Database LSM-35668 LINCS View more database links