(3As,4R,7R,8S,9S,10R,11R,13R,15R,15Ar)-4-Ethyl-11-Methoxy-3A,7,9,11,13,15-Hexamethyl-2,6,14-Trioxo-10-{[3,4,6-Trideoxy-3-(Dimethylamino)-β-D-Xylo-Hexopyranosyl]Oxy}Tetradecahydro-2H-Oxacyclotetrade Cino[4,3-D][1,3]Oxazol-8-Yl (2R)-2-(4-Acetamidophenyl)-2,3-Dihydro-1H-Pyrrole-1-Carboxylate

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Formula C44H66N4O12
IUPAC Name [(1r,2r,4r,6r,7r,8s,9s,10r,13r,14s)-7-[(2s,3r,4s,6r)-4-(dimethylamino)-3-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-13-ethyl-6-methoxy-2,4,6,8,10,14-hexamethyl-3,11,16-trioxo-12,15-dioxa-17-azabicyclo[12.3.0]heptadecan-9-yl] (2r)-2-(4-acetamidophenyl)-2,3-dihydropyrrole-1-carboxylate
Molecular Mass 843.014 g·mol−1
Heat of Formation -2272.0 ± 16.7 kJ·mol−1
Dipole Moment 6.80 ± 1.08 D
Volume 1036.38 Å 3
Surface Area 647.4 Å 2
HOMO Energy -8.57 ± 0.55 eV
LUMO Energy 0.07 ± eV
Point Group Symmetry C1
InChIKey ZKTKUJCCBJLCJA-RDDSPYQVSA-N
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