(5R)-5-(1,2-Dihydroxyethyl)-4-Hydroxy-3-{[(2S,5R,6S)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydro-2H-Pyran-2-Yl]Oxy}-2(5H)-Furanone

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Properties Simple | Detailed

Formula C12H18O11
IUPAC Name (2r)-2-[(1s)-1,2-dihydroxyethyl]-3-hydroxy-4-[(2s,3r,4r,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-2h-furan-5-one
Molecular Mass 338.265 g·mol−1
Heat of Formation -1848.0 ± 16.7 kJ·mol−1
Dipole Moment 6.50 ± 1.08 D
Volume 361.34 Å 3
Surface Area 303.09 Å 2
HOMO Energy -9.62 ± 0.55 eV
LUMO Energy -0.42 ± eV
Point Group Symmetry C1
InChIKey MLSJBGYKDYSOAE-NJNDHDISSA-N
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Elements H C O