(1R,2S,3R,4R,5S,8R,9S,10S,11R,12R,14R)-5-(2-fluoranylethyl)-9-[(2S,4S,6S)-4-methoxy-4,6-dimethyl-oxan-2-yl]oxy-2,4,8,10,12,14-hexamethyl-11-[(2S,3R,4S,6R)-6-methyl-4-[methyl(propan-2-yl)amino]-3-oxidanyl-oxan-2-yl]oxy-3,4-bis(oxidanyl)-15-oxa-6-azabicyclo[10.2.1]pentadecan-7-one

Systemtic Name: (1R,2S,3R,4R,5S,8R,9S,10S,11R,12R,14R)-5-(2-fluoranylethyl)-9-[(2S,4S,6S)-4-methoxy-4,6-dimethyl-oxan-2-yl]oxy-2,4,8,10,12,14-hexamethyl-11-[(2S,3R,4S,6R)-6-methyl-4-[methyl(propan-2-yl)amino]-3-oxidanyl-oxan-2-yl]oxy-3,4-bis(oxidanyl)-15-oxa-6-azabicyclo[10.2.1]pentadecan-7-one Openeye Name: (1R,2S,3R,4R,5S,8R,9S,10S,11R,12R,14R)-5-(2-fluoroethyl)-3,4-dihydroxy-11-[(2S,3R,4S,6R)-3-hydroxy-4-[isopropyl(methyl)amino]-6-methyl-tetrahydropyran-2-yl]oxy-9-[(2S,4S,6S)-4-methoxy-4,6-dimethyl-tetrahydropyran-2-yl]oxy-2,4,8,10,12,14-hexamethyl-15-oxa-6-azabicyclo[10.2.1]pentadecan-7-one CAS Name: (1R,2S,3R,4R,5S,8R,9S,10S,11R,12R,14R)-5-(2-fluoroethyl)-3,4-dihydroxy-11-[[(2S,3R,4S,6R)-3-hydroxy-6-methyl-4-[methyl(propan-2-yl)amino]-2-oxanyl]oxy]-9-[[(2S,4S,6S)-4-methoxy-4,6-dimethyl-2-oxanyl]oxy]-2,4,8,10,12,14-hexamethyl-15-oxa-6-azabicyclo[10.2.1]pentadecan-7-one IUPAC Name: (1R,2S,3R,4R,5S,8R,9S,10S,11R,12R,14R)-5-(2-fluoroethyl)-3,4-dihydroxy-11-[(2S,3R,4S,6R)-3-hydroxy-6-methyl-4-[methyl(propan-2-yl)amino]oxan-2-yl]oxy-9-[(2S,4S,6S)-4-methoxy-4,6-dimethyloxan-2-yl]oxy-2,4,8,10,12,14-hexamethyl-15-oxa-6-azabicyclo[10.2.1]pentadecan-7-one Traditional Name: (1R,2S,3R,4R,5S,8R,9S,10S,11R,12R,14R)-5-(2-fluoroethyl)-3,4-dihydroxy-11-[(2S,3R,4S,6R)-3-hydroxy-4-[isopropyl(methyl)amino]-6-methyl-tetrahydropyran-2-yl]oxy-9-[(2S,4S,6S)-4-methoxy-4,6-dimethyl-tetrahydropyran-2-yl]oxy-2,4,8,10,12,14-hexamethyl-15-oxa-6-azabicyclo[10.2.1]pentadecan-7-one Formula: C39H71FN2O10 MolecularWeight: 746.986843

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C(C(O1)OC2C(C(C(C(=O)NC(C(C(C(C3C(CC2(O3)C)C)C)O)(C)O)CCF)C)OC4CC(CC(O4)C)(C)OC)C)O)N(C)C(C)C

Isomeric SMILES

C[C@@H]1C[C@@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H]([C@H](C(=O)N[C@H]([C@@]([C@@H]([C@@H]([C@H]3[C@@H](C[C@]2(O3)C)C)C)O)(C)O)CCF)C)O[C@H]4C[C@@](C[C@@H](O4)C)(C)OC)C)O)N(C)C(C)C

InChI

InChI=1S/C39H71FN2O10/c1-20(2)42(12)27-16-22(4)49-36(30(27)43)51-34-25(7)32(50-29-19-37(9,47-13)18-23(5)48-29)26(8)35(45)41-28(14-15-40)39(11,46)33(44)24(6)31-21(3)17-38(34,10)52-31/h20-34,36,43-44,46H,14-19H2,1-13H3,(H,41,45)/t21-,22-,23+,24-,25+,26-,27+,28+,29+,30-,31-,32+,33-,34-,36+,37+,38-,39-/m1/s1