CHEBI:126607 - 1-[(3S,9R,10R)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-3-(1-naphthalenyl)urea

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ChEBI Name 1-[(3S,9R,10R)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-3-(1-naphthalenyl)urea ChEBI ID CHEBI:126607 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 C41H49F3N4O5 Net Charge 0 Average Mass 734.848 Monoisotopic Mass 734.36551 InChI InChI=1S/C41H49F3N4O5/c1-27-23-48(28(2)26-49)39(50)35-22-33(45-40(51)46-36-14-9-12-31-11-5-6-13-34(31)36)19-20-37(35)53-29(3)10-7-8-21-52-38(27)25-47(4)24-30-15-17-32(18-16-30)41(42,43)44/h5-6,9,11-20,22,27-29,38,49H,7-8,10,21,23-26H2,1-4H3,(H2,45,46,51)/t27-,28+,29+,38+/m1/s1 InChIKey IOGICXGLCRDSGV-MWBBNKDSSA-N SMILES C[C@H]1CCCCO[C@H]([C@@H](CN(C(=O)C2=C(O1)C=CC(=C2)NC(=O)NC3=CC=CC4=CC=CC=C43)[C@@H](C)CO)C)CN(C)CC5=CC=C(C=C5)C(F)(F)F ChEBI Ontology Outgoing 1-[(3S,9R,10R)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-3-(1-naphthalenyl)urea (CHEBI:126607) is a azamacrocycle (CHEBI:52898) 1-[(3S,9R,10R)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-3-(1-naphthalenyl)urea (CHEBI:126607) is a lactam (CHEBI:24995) Manual Xref Database LSM-38170 LINCS View more database links Last Modified 03 March 2016