[(2S,3S,4R,6R)-6-[[(1S,2R,3R,8S,9R,10R,16S,17E,18R)-9-[(2S,3R,4S,6R)-4-(dimethylamino)-6-methyl-3-oxidanyl-oxan-2-yl]oxy-3-ethyl-17-hydroxyimino-2,6,8,10,13,16,18-heptamethyl-2-oxidanyl-5-oxidanylidene-4,11,15-trioxabicyclo[8.5.4]nonadecan-7-yl]oxy]-4-methoxy-2,4-dimethyl-oxan-3-yl] ethanoate

Systemtic Name: [(2S,3S,4R,6R)-6-[[(1S,2R,3R,8S,9R,10R,16S,17E,18R)-9-[(2S,3R,4S,6R)-4-(dimethylamino)-6-methyl-3-oxidanyl-oxan-2-yl]oxy-3-ethyl-17-hydroxyimino-2,6,8,10,13,16,18-heptamethyl-2-oxidanyl-5-oxidanylidene-4,11,15-trioxabicyclo[8.5.4]nonadecan-7-yl]oxy]-4-methoxy-2,4-dimethyl-oxan-3-yl] ethanoate Openeye Name: [(2S,3S,4R,6R)-6-[[(1S,2R,3R,8S,9R,10R,16S,17E,18R)-9-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-3-ethyl-2-hydroxy-17-hydroxyimino-2,6,8,10,13,16,18-heptamethyl-5-oxo-4,11,15-trioxabicyclo[8.5.4]nonadecan-7-yl]oxy]-4-methoxy-2,4-dimethyl-tetrahydropyran-3-yl] acetate CAS Name: acetic acid [(2S,3S,4R,6R)-6-[[(1S,2R,3R,8S,9R,10R,16S,17E,18R)-9-[[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyl-2-oxanyl]oxy]-3-ethyl-2-hydroxy-17-hydroxyimino-2,6,8,10,13,16,18-heptamethyl-5-oxo-4,11,15-trioxabicyclo[8.5.4]nonadecan-7-yl]oxy]-4-methoxy-2,4-dimethyl-3-oxanyl] ester IUPAC Name: [(2S,3S,4R,6R)-6-[[(1S,2R,3R,8S,9R,10R,16S,17E,18R)-9-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-3-ethyl-2-hydroxy-17-hydroxyimino-2,6,8,10,13,16,18-heptamethyl-5-oxo-4,11,15-trioxabicyclo[8.5.4]nonadecan-7-yl]oxy]-4-methoxy-2,4-dimethyloxan-3-yl] acetate Traditional Name: acetic acid [(2S,3S,4R,6R)-6-[[(1S,2R,3R,8S,9R,10R,16S,17E,18R)-9-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-3-ethyl-17-hydroximino-2-hydroxy-5-keto-2,6,8,10,13,16,18-heptamethyl-4,11,15-trioxabicyclo[8.5.4]nonadecan-7-yl]oxy]-4-methoxy-2,4-dimethyl-tetrahydropyran-3-yl] ester Formula: C43H76N2O14 MolecularWeight: 845.06854

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(C2C(C(=NO)C(CC(C(C(C(C(C(=O)O1)C)OC3CC(C(C(O3)C)OC(=O)C)(C)OC)C)OC4C(C(CC(O4)C)N(C)C)O)(OCC(CO2)C)C)C)C)(C)O

Isomeric SMILES

CC[C@@H]1[C@@]([C@@H]2[C@H](/C(=N/O)/[C@@H](C[C@]([C@@H]([C@H](C(C(C(=O)O1)C)O[C@H]3C[C@@]([C@H]([C@@H](O3)C)OC(=O)C)(C)OC)C)O[C@H]4[C@@H]([C@H](C[C@H](O4)C)N(C)C)O)(OCC(CO2)C)C)C)C)(C)O

InChI

InChI=1S/C43H76N2O14/c1-16-31-43(12,49)37-25(5)33(44-50)23(3)18-42(11,53-21-22(2)20-52-37)36(59-40-34(47)30(45(13)14)17-24(4)54-40)26(6)35(27(7)39(48)57-31)58-32-19-41(10,51-15)38(28(8)55-32)56-29(9)46/h22-28,30-32,34-38,40,47,49-50H,16-21H2,1-15H3/b44-33+/t22?,23-,24-,25+,26+,27?,28+,30+,31-,32+,34-,35?,36-,37+,38+,40+,41-,42-,43-/m1/s1