3,5-Dicaffeoylquinic Acid Chemical Identity
3,5-Dicaffeoylquinic acid has the molecular formula C25H24O12 and the molecular weight 516.4, and the CAS number is 2450-53-5. In 3,5-dicaffeoylquinic acid the two caffeoyl groups sit at positions 3 and 5 of the quinic acid ring, separated by the free hydroxyl at C4, and the hydroxyl at C1 stays free beside the carboxyl group. The geometry places the two catechol rings on the same face of the ring system but farther apart than in the 3,4 or 4,5 isomers, which affects how the molecule packs and how it elutes.
The old Chinese trade names label 3,5-dicaffeoylquinic acid isochlorogenic acid A, while the 3,4 and 4,5 isomers are isochlorogenic acids B and C. Western papers use the locants, so a buyer who reads both literatures needs the two names side by side. The natural source is the flower of Lonicera japonica Thunb., in which chlorogenic acid is the dominant caffeoylquinic acid and the 3,5 isomer is among the more abundant dicaffeoyl forms. The same flower is also supplied as Honeysuckle Extract 5–25% Chlorogenic Acid, the 10:1 Honeysuckle Flower Extract Powder and the milled Honeysuckle Flower Powder. Those materials are defined by other markers, while this acid is one isomer. Quality teams that buy several of them keep the labels apart, because a certificate for the mixed extract does not describe single 3,5-dicaffeoylquinic acid, and a certificate for the single compound says little about the extract.












