CHEBI:127508 - N-[(3S,9S,10S)-9-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]cyclohexanecarboxamide

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ChEBI Name N-[(3S,9S,10S)-9-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]cyclohexanecarboxamide ChEBI ID CHEBI:127508 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 C36H51Cl2N3O5 Net Charge 0 Average Mass 676.714 Monoisotopic Mass 675.32058 InChI InChI=1S/C36H51Cl2N3O5/c1-24-20-41(25(2)23-42)36(44)30-19-29(39-35(43)28-11-6-5-7-12-28)14-16-33(30)46-26(3)10-8-9-17-45-34(24)22-40(4)21-27-13-15-31(37)32(38)18-27/h13-16,18-19,24-26,28,34,42H,5-12,17,20-23H2,1-4H3,(H,39,43)/t24-,25+,26-,34+/m0/s1 InChIKey GIJXROWDOWXZEB-QZCKSCMDSA-N SMILES C[C@H]1CCCCO[C@@H]([C@H](CN(C(=O)C2=C(O1)C=CC(=C2)NC(=O)C3CCCCC3)[C@H](C)CO)C)CN(C)CC4=CC(=C(C=C4)Cl)Cl ChEBI Ontology Outgoing N-[(3S,9S,10S)-9-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]cyclohexanecarboxamide (CHEBI:127508) is a azamacrocycle (CHEBI:52898) N-[(3S,9S,10S)-9-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]cyclohexanecarboxamide (CHEBI:127508) is a lactam (CHEBI:24995) Manual Xref Database LSM-39066 LINCS View more database links Last Modified 03 March 2016