(1S,3S)-3-Ethyl-3,10,12-Trihydroxy-6,11-Dioxo-1,2,3,4,6,11-Hexahydro-1-Tetracenyl 2,3,6-Trideoxy-4-O-{2,6-Dideoxy-4-O-[(2R,6R)-6-Methyl-5-Oxotetrahydro-2H-Pyran-2-Yl]-β-L-Arabino-Hexopyranosyl}-3-(Dimethylamino)-Alpha-L-Lyxo-Hexopyranoside

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Properties Simple | Detailed

Formula C40H51NO13
IUPAC Name (7s,9s)-7-[(2r,4s,5s,6s)-4-(dimethylamino)-5-[(2r,4s,5r,6s)-4-hydroxy-6-methyl-5-[(2r,6r)-6-methyl-5-oxo-tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-6-methyl-tetrahydropyran-2-yl]oxy-9-ethyl-4,6,9-trihydroxy-8,10-dihydro-7h-tetracene-5,12-dione
Molecular Mass 753.832 g·mol−1
Heat of Formation -2257.1 ± 16.7 kJ·mol−1
Dipole Moment 5.06 ± 1.08 D
Volume 874.18 Å 3
Surface Area 675.33 Å 2
HOMO Energy -8.59 ± 0.55 eV
LUMO Energy -1.79 ± eV
Point Group Symmetry C1
InChIKey OXPCRXLITLBLEY-ZVNFQBCFSA-N
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