[(3R,5S,6R,7S,8E,10S,11S,12Z,14E)-5,11,21-trimethoxy-3,7,9,15-tetramethyl-6-oxidanyl-16,22-bis(oxidanylidene)-20-(prop-2-enoxyamino)-17-azabicyclo[16.3.1]docosa-1(21),8,12,14,17,19-hexaen-10-yl] carbamate

Systemtic Name: [(3R,5S,6R,7S,8E,10S,11S,12Z,14E)-5,11,21-trimethoxy-3,7,9,15-tetramethyl-6-oxidanyl-16,22-bis(oxidanylidene)-20-(prop-2-enoxyamino)-17-azabicyclo[16.3.1]docosa-1(21),8,12,14,17,19-hexaen-10-yl] carbamate Openeye Name: [(3R,5S,6R,7S,8E,10S,11S,12Z,14E)-20-(allyloxyamino)-6-hydroxy-5,11,21-trimethoxy-3,7,9,15-tetramethyl-16,22-dioxo-17-azabicyclo[16.3.1]docosa-1(21),8,12,14,17,19-hexaen-10-yl] carbamate CAS Name: carbamic acid [(3R,5S,6R,7S,8E,10S,11S,12Z,14E)-6-hydroxy-5,11,21-trimethoxy-3,7,9,15-tetramethyl-16,22-dioxo-20-(prop-2-enoxyamino)-17-azabicyclo[16.3.1]docosa-1(21),8,12,14,17,19-hexaen-10-yl] ester IUPAC Name: [(3R,5S,6R,7S,8E,10S,11S,12Z,14E)-6-hydroxy-5,11,21-trimethoxy-3,7,9,15-tetramethyl-16,22-dioxo-20-(prop-2-enoxyamino)-17-azabicyclo[16.3.1]docosa-1(21),8,12,14,17,19-hexaen-10-yl] carbamate Traditional Name: carbamic acid [(3R,5S,6R,7S,8E,10S,11S,12Z,14E)-20-(allyloxyamino)-6-hydroxy-16,22-diketo-5,11,21-trimethoxy-3,7,9,15-tetramethyl-17-azabicyclo[16.3.1]docosa-1(21),8,12,14,17,19-hexaen-10-yl] ester Formula: C32H45N3O9 MolecularWeight: 615.7144

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C(C(C=C(C(C(C=CC=C(C(=O)N=C2C=C(C(=C(C1)C2=O)OC)NOCC=C)C)OC)OC(=O)N)C)C)O)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)N=C2C=C(C(=C(C1)C2=O)OC)NOCC=C)/C)OC)OC(=O)N)\C)C)O)OC

InChI

InChI=1S/C32H45N3O9/c1-9-13-43-35-24-17-23-28(37)22(30(24)42-8)14-18(2)15-26(41-7)27(36)20(4)16-21(5)29(44-32(33)39)25(40-6)12-10-11-19(3)31(38)34-23/h9-12,16-18,20,25-27,29,35-36H,1,13-15H2,2-8H3,(H2,33,39)/b12-10-,19-11+,21-16+,34-23?/t18-,20+,25+,26+,27-,29+/m1/s1