CHEBI:104788 - 4-[[[(3S,9R,10R)-16-(dimethylamino)-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-9-yl]methyl-methylamino]methyl]benzoic acid

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ChEBI Name 4-[[[(3S,9R,10R)-16-(dimethylamino)-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-9-yl]methyl-methylamino]methyl]benzoic acid ChEBI ID CHEBI:104788 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 C32H47N3O6 Net Charge 0 Average Mass 569.733 Monoisotopic Mass 569.34649 InChI InChI=1S/C32H47N3O6/c1-22-18-35(23(2)21-36)31(37)28-17-27(33(4)5)14-15-29(28)41-24(3)9-7-8-16-40-30(22)20-34(6)19-25-10-12-26(13-11-25)32(38)39/h10-15,17,22-24,30,36H,7-9,16,18-21H2,1-6H3,(H,38,39)/t22-,23-,24+,30+/m1/s1 InChIKey JGZXBABAHUXSMS-UCTCLUAXSA-N SMILES C[C@H]1CCCCO[C@H]([C@@H](CN(C(=O)C2=C(O1)C=CC(=C2)N(C)C)[C@H](C)CO)C)CN(C)CC3=CC=C(C=C3)C(=O)O ChEBI Ontology Outgoing 4-[[[(3S,9R,10R)-16-(dimethylamino)-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-9-yl]methyl-methylamino]methyl]benzoic acid (CHEBI:104788) is a azamacrocycle (CHEBI:52898) 4-[[[(3S,9R,10R)-16-(dimethylamino)-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-9-yl]methyl-methylamino]methyl]benzoic acid (CHEBI:104788) is a lactam (CHEBI:24995) Manual Xref Database LSM-16151 LINCS View more database links