(1S)-1,5-Anhydro-2,6-Dideoxy-1-(1,6,10-Trihydroxy-8-Methyl-5,12-Dioxo-5,12-Dihydro-2-Tetracenyl)-D-Arabino-Hexitol

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Properties Simple | Detailed

Formula C25H22O8
IUPAC Name 2-[(2r,4s,5s,6r)-4,5-dihydroxy-6-methyl-tetrahydropyran-2-yl]-1,6,10-trihydroxy-8-methyl-tetracene-5,12-dione
Molecular Mass 450.437 g·mol−1
Heat of Formation -1188.9 ± 16.7 kJ·mol−1
Dipole Moment 3.67 ± 1.08 D
Volume 485.6 Å 3
Surface Area 414.44 Å 2
HOMO Energy -8.72 ± 0.55 eV
LUMO Energy 1.69 ± eV
Point Group Symmetry C1
InChIKey PBTVAODWGBKPII-OQNGNEGCSA-N
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Elements H C O