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. 2021 Aug 18;476(12):4287–4299. doi: 10.1007/s11010-021-04243-w

Table 2.

Total net excess charge and hydrogen atom removal energy (kJ/mol) of quercetin, catechin, and naringenin hydroxyl groups

Hydroxyl group OH-3 OH-5 OH-7 OH-3′ OH-4′
Naringenin Bond dissociation energy  − 365,59  − 352,19  − 333,35
Total net excess charge  − 0.317  − 0.355  − 0.372
Quercetin Bond dissociation energy  − 309,15  − 367,35  − 355,63  − 316,69  − 539,42
Total net excess charge  − 0.344  − 0.311  − 0.353  − 0.392  − 0.338
Catechin Bond dissociation energy  − 435,34  − 435,76  − 334,85  − 317,27  − 313,93
Total net excess charge  − 0.33  − 0.361  − 0.37  − 0.345  − 0.346