[(2R,3S,5S,6R,7S,8E,10S,11S,12E,14Z)-19-bromanyl-2,5,6,11-tetramethoxy-3,7,9,15-tetramethyl-16,20,22-tris(oxidanylidene)-17-azabicyclo[16.3.1]docosa-1(21),8,12,14,18-pentaen-10-yl] carbamate

Systemtic Name: [(2R,3S,5S,6R,7S,8E,10S,11S,12E,14Z)-19-bromanyl-2,5,6,11-tetramethoxy-3,7,9,15-tetramethyl-16,20,22-tris(oxidanylidene)-17-azabicyclo[16.3.1]docosa-1(21),8,12,14,18-pentaen-10-yl] carbamate Openeye Name: [(2R,3S,5S,6R,7S,8E,10S,11S,12E,14Z)-19-bromo-2,5,6,11-tetramethoxy-3,7,9,15-tetramethyl-16,20,22-trioxo-17-azabicyclo[16.3.1]docosa-1(21),8,12,14,18-pentaen-10-yl] carbamate CAS Name: carbamic acid [(2R,3S,5S,6R,7S,8E,10S,11S,12E,14Z)-19-bromo-2,5,6,11-tetramethoxy-3,7,9,15-tetramethyl-16,20,22-trioxo-17-azabicyclo[16.3.1]docosa-1(21),8,12,14,18-pentaen-10-yl] ester IUPAC Name: [(2R,3S,5S,6R,7S,8E,10S,11S,12E,14Z)-19-bromo-2,5,6,11-tetramethoxy-3,7,9,15-tetramethyl-16,20,22-trioxo-17-azabicyclo[16.3.1]docosa-1(21),8,12,14,18-pentaen-10-yl] carbamate Traditional Name: carbamic acid [(2R,3S,5S,6R,7S,8E,10S,11S,12E,14Z)-19-bromo-16,20,22-triketo-2,5,6,11-tetramethoxy-3,7,9,15-tetramethyl-17-azabicyclo[16.3.1]docosa-1(21),8,12,14,18-pentaen-10-yl] ester Formula: C30H41BrN2O9 MolecularWeight: 653.55854

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C(C(C=C(C(C(C=CC=C(C(=O)NC2=C(C(=O)C=C(C1OC)C2=O)Br)C)OC)OC(=O)N)C)C)OC)OC

Isomeric SMILES

C[C@H]1C[C@@H]([C@@H]([C@H](/C=C(/[C@@H]([C@H](/C=C/C=C(\C(=O)NC2=C(C(=O)C=C([C@@H]1OC)C2=O)Br)/C)OC)OC(=O)N)\C)C)OC)OC

InChI

InChI=1S/C30H41BrN2O9/c1-15-10-9-11-21(38-5)28(42-30(32)37)17(3)12-16(2)27(41-8)22(39-6)13-18(4)26(40-7)19-14-20(34)23(31)24(25(19)35)33-29(15)36/h9-12,14,16,18,21-22,26-28H,13H2,1-8H3,(H2,32,37)(H,33,36)/b11-9+,15-10-,17-12+/t16-,18-,21-,22-,26+,27+,28-/m0/s1