CHEBI:111611 - 1-[[(2S,3R)-10-(dimethylamino)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-2-yl]methyl]-1-methyl-3-(1-naphthalenyl)urea

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ChEBI Name 1-[[(2S,3R)-10-(dimethylamino)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-2-yl]methyl]-1-methyl-3-(1-naphthalenyl)urea ChEBI ID CHEBI:111611 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 C29H36N4O4 Net Charge 0 Average Mass 504.622 Monoisotopic Mass 504.27366 InChI InChI=1S/C29H36N4O4/c1-19-16-33(20(2)18-34)28(35)23-13-9-15-25(31(3)4)27(23)37-26(19)17-32(5)29(36)30-24-14-8-11-21-10-6-7-12-22(21)24/h6-15,19-20,26,34H,16-18H2,1-5H3,(H,30,36)/t19-,20-,26-/m1/s1 InChIKey QINKYHPKCUNNMN-XMERXJNXSA-N SMILES C[C@@H]1CN(C(=O)C2=C(C(=CC=C2)N(C)C)O[C@@H]1CN(C)C(=O)NC3=CC=CC4=CC=CC=C43)[C@H](C)CO ChEBI Ontology Outgoing 1-[[(2S,3R)-10-(dimethylamino)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-2-yl]methyl]-1-methyl-3-(1-naphthalenyl)urea (CHEBI:111611) is a naphthalenes (CHEBI:25477) Manual Xref Database LSM-23025 LINCS View more database links