Kaempferol 3-O-Rutinose

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Formula C27H31O15+
IUPAC Name 5,7-dihydroxy-2-(4-hydroxyphenyl)-3-[(2s,3s,4s,5s,6r)-3,4,5-trihydroxy-6-[[(2r,3r,4s,5r,6r)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxymethyl]tetrahydropyran-2-yl]oxy-chromen-4-one
Molecular Mass 595.526 g·mol−1
Heat of Formation -2533.0 ± 16.7 kJ·mol−1
Dipole Moment 5.54 ± 1.08 D
Volume 622.74 Å 3
Surface Area 454.89 Å 2
HOMO Energy -9.10 ± 0.55 eV
LUMO Energy 2.06 ± eV
Point Group Symmetry C1
InChIKey RTATXGUCZHCSNG-QRRIJVELSA-N
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Elements H C O