Methyl (1S,4As,7S,7Ar)-1-(β-L-Glucopyranosyloxy)-7-Methyl-5-Oxo-1,4A,5,6,7,7A-Hexahydrocyclopenta[C]Pyran-4-Carboxylate

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Properties Simple | Detailed

Formula C17H24O10
IUPAC Name methyl (1s,4as,7s,7ar)-7-methyl-5-oxo-1-[(2r,3s,4r,5r,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-4a,6,7,7a-tetrahydro-1h-cyclopenta[c]pyran-4-carboxylate
Molecular Mass 388.366 g·mol−1
Heat of Formation -1764.0 ± 16.7 kJ·mol−1
Dipole Moment 6.05 ± 1.08 D
Volume 434.57 Å 3
Surface Area 365.76 Å 2
HOMO Energy -9.52 ± 0.55 eV
LUMO Energy -0.01 ± eV
Point Group Symmetry C1
InChIKey HLXRWTJXGMHOFN-UDHWGNCTSA-N
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Elements H C O