(13Z)-9-[4-(dimethylamino)-6-methyl-3-oxidanyl-oxan-2-yl]oxy-3-ethyl-2,6,8,10,16,18-hexamethyl-17-methylimino-2-oxidanyl-13-[(6-pyrazol-1-ylpyridin-3-yl)methoxyimino]-4,11,15-trioxabicyclo[8.5.4]nonadecane-5,7-dione

Systemtic Name: (13Z)-9-[4-(dimethylamino)-6-methyl-3-oxidanyl-oxan-2-yl]oxy-3-ethyl-2,6,8,10,16,18-hexamethyl-17-methylimino-2-oxidanyl-13-[(6-pyrazol-1-ylpyridin-3-yl)methoxyimino]-4,11,15-trioxabicyclo[8.5.4]nonadecane-5,7-dione Openeye Name: (13Z)-9-[4-(dimethylamino)-3-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-3-ethyl-2-hydroxy-2,6,8,10,16,18-hexamethyl-17-methylimino-13-[(6-pyrazol-1-yl-3-pyridyl)methoxyimino]-4,11,15-trioxabicyclo[8.5.4]nonadecane-5,7-dione CAS Name: (13Z)-9-[[4-(dimethylamino)-3-hydroxy-6-methyl-2-oxanyl]oxy]-3-ethyl-2-hydroxy-2,6,8,10,16,18-hexamethyl-17-methylimino-13-[[6-(1-pyrazolyl)-3-pyridinyl]methoxyimino]-4,11,15-trioxabicyclo[8.5.4]nonadecane-5,7-dione IUPAC Name: (13Z)-9-[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-3-ethyl-2-hydroxy-2,6,8,10,16,18-hexamethyl-17-methylimino-13-[(6-pyrazol-1-ylpyridin-3-yl)methoxyimino]-4,11,15-trioxabicyclo[8.5.4]nonadecane-5,7-dione Traditional Name: (13Z)-9-[4-(dimethylamino)-3-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-3-ethyl-2-hydroxy-2,6,8,10,16,18-hexamethyl-17-methylimino-13-[(6-pyrazol-1-yl-3-pyridyl)methyloximino]-4,11,15-trioxabicyclo[8.5.4]nonadecane-5,7-quinone Formula: C42H64N6O10 MolecularWeight: 812.99176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1C(C2C(C(=NC)C(CC(C(C(C(=O)C(C(=O)O1)C)C)OC3C(C(CC(O3)C)N(C)C)O)(OCC(=NOCC4=CN=C(C=C4)N5C=CC=N5)CO2)C)C)C)(C)O

Isomeric SMILES

CCC1C(C2C(C(=NC)C(CC(C(C(C(=O)C(C(=O)O1)C)C)OC3C(C(CC(O3)C)N(C)C)O)(OC/C(=N\OCC4=CN=C(C=C4)N5C=CC=N5)/CO2)C)C)C)(C)O

InChI

InChI=1S/C42H64N6O10/c1-12-32-42(8,52)38-26(4)34(43-9)24(2)19-41(7,54-23-30(22-53-38)46-55-21-29-14-15-33(44-20-29)48-17-13-16-45-48)37(27(5)35(49)28(6)39(51)57-32)58-40-36(50)31(47(10)11)18-25(3)56-40/h13-17,20,24-28,31-32,36-38,40,50,52H,12,18-19,21-23H2,1-11H3/b43-34?,46-30-