(1S,2R,3R,8S,9R,10R,16R,19R)-9-[(2S,3R,4S,6R)-4-(dimethylamino)-6-methyl-3-oxidanyl-oxan-2-yl]oxy-3-ethyl-2,6,8,10,16,17,19-heptamethyl-13-methylidene-2,7-bis(oxidanyl)-4,11,15-trioxa-17-azabicyclo[8.5.5]icosan-5-one

Systemtic Name: (1S,2R,3R,8S,9R,10R,16R,19R)-9-[(2S,3R,4S,6R)-4-(dimethylamino)-6-methyl-3-oxidanyl-oxan-2-yl]oxy-3-ethyl-2,6,8,10,16,17,19-heptamethyl-13-methylidene-2,7-bis(oxidanyl)-4,11,15-trioxa-17-azabicyclo[8.5.5]icosan-5-one Openeye Name: (1S,2R,3R,8S,9R,10R,16R,19R)-9-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-3-ethyl-2,7-dihydroxy-2,6,8,10,16,17,19-heptamethyl-13-methylene-4,11,15-trioxa-17-azabicyclo[8.5.5]icosan-5-one CAS Name: (1S,2R,3R,8S,9R,10R,16R,19R)-9-[[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyl-2-oxanyl]oxy]-3-ethyl-2,7-dihydroxy-2,6,8,10,16,17,19-heptamethyl-13-methylene-4,11,15-trioxa-17-azabicyclo[8.5.5]eicosan-5-one IUPAC Name: (1S,2R,3R,8S,9R,10R,16R,19R)-9-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-3-ethyl-2,7-dihydroxy-2,6,8,10,16,17,19-heptamethyl-13-methylidene-4,11,15-trioxa-17-azabicyclo[8.5.5]icosan-5-one Traditional Name: (1S,2R,3R,8S,9R,10R,16R,19R)-9-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-3-ethyl-2,7-dihydroxy-2,6,8,10,16,17,19-heptamethyl-13-methylene-4,11,15-trioxa-17-azabicyclo[8.5.5]eicosan-5-one Formula: C34H62N2O9 MolecularWeight: 642.86408

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(C2C(N(CC(CC(C(C(C(C(C(=O)O1)C)O)C)OC3C(C(CC(O3)C)N(C)C)O)(OCC(=C)CO2)C)C)C)C)(C)O

Isomeric SMILES

CC[C@@H]1[C@@]([C@@H]2[C@H](N(C[C@@H](C[C@]([C@@H]([C@H](C(C(C(=O)O1)C)O)C)O[C@H]3[C@@H]([C@H](C[C@H](O3)C)N(C)C)O)(OCC(=C)CO2)C)C)C)C)(C)O

InChI

InChI=1S/C34H62N2O9/c1-13-26-34(9,40)30-24(7)36(12)16-19(2)15-33(8,42-18-20(3)17-41-30)29(22(5)27(37)23(6)31(39)44-26)45-32-28(38)25(35(10)11)14-21(4)43-32/h19,21-30,32,37-38,40H,3,13-18H2,1-2,4-12H3/t19-,21-,22+,23?,24-,25+,26-,27?,28-,29-,30+,32+,33-,34-/m1/s1