Phenolic Profiling of <i>Laurus nobilis</i> by LC-ESI-MS/MS: In Vitro Bioactivities and In Silico Enzyme Docking


Bak F. E., Canbolat Gültekin D., Akmeşe O., Atalay A., Turan İ., Gültekin E., ...More

CHEMISTRY & BIODIVERSITY, vol.23, no.2, 2026 (SCI-Expanded, Scopus) identifier identifier identifier

  • Publication Type: Article / Article
  • Volume: 23 Issue: 2
  • Publication Date: 2026
  • Doi Number: 10.1002/cbdv.202503616
  • Journal Name: CHEMISTRY & BIODIVERSITY
  • Journal Indexes: Science Citation Index Expanded (SCI-EXPANDED), Scopus, Chemical Abstracts Core, EMBASE, MEDLINE
  • Keywords: antioxidant activity, Laurus nobilis, LC–ESI–MS/MS, phenolic compounds, α-amylase/α-glucosidase inhibition
  • Karadeniz Technical University Affiliated: Yes

Abstract

This study evaluated the branch, leaf, and fruit extracts of Laurus nobilis collected from Artvin in terms of phenolic composition, antioxidant, antimicrobial, and antidiabetic activities and additionally investigated the binding of selected phenolics to alpha-amylase/alpha-glucosidase targets through molecular docking. Using LC-ESI-MS/MS analysis, 31 phenolic compounds were quantitatively identified, with epicatechin, luteolin-7-O-glucoside, and rutin predominating particularly in the branches and leaves. Antioxidant capacity was higher in branches and leaves (total phenolic content [TPC]/FRAP/DPPH IC50: branches and leaves, respectively, 95.27-60.84 mg gallic acid equivalent [GAE]/g, 206.16-162.05 mg Trolox equivalent [TE]/g, and 46.95-113.49 & micro;g/mL). Antimicrobial activity was observed within a minimum inhibitory concentration (MIC) range of 1.25-10 mg/mL; leaves exhibited the strongest effect against Bacillus cereus (1.25 mg/mL), whereas fruits were most effective against Candida albicans (1.25 mg/mL). In antidiabetic evaluation, fruits yielded the lowest IC50 values against alpha-amylase and alpha-glucosidase (4.31 and 8.97 mg/mL, respectively), suggesting a "composition-over-quantity" effect despite low total phenolic content. Docking results supported high binding affinities of rutin (alpha-glucosidase -9.3 kcal/mol; alpha-amylase -8.1 kcal/mol) and luteolin (-8.6 kcal/mol for both enzymes). Overall, although branches and leaves exhibited strong antioxidant profiles, fruits showed more pronounced inhibitory effects on digestive enzymes; therefore, fractionation studies and in vivo/kinetic validations are recommended.