Quantitative Structure Activity Relationship of Cinnamaldehyde Compounds against Wood-Decaying Fungi.

Trametes versicolor

OncologyImmune support

SpeciesTurkey Tail, Yun Zhi

JournalMolecules (Basel, Switzerland)

Year2016

Key points

Cinnamaldehyde, of the genius Cinnamomum, is a major constituent of the bark of the cinnamon tree and possesses broad-spectrum antimicrobial activity
In this study, we used best multiple linear regression (BMLR) to develop quantitative structure activity relationship (QSAR) models for cinnamaldehyde derivatives against wood-decaying fungi Trametes versicolor and Gloeophyllun trabeum
Based on the two optimal QSAR models, we then designed and synthesized two novel cinnamaldehyde compounds
The QSAR models exhibited good correlation coefficients: R ² Tv = 0.910 for Trametes versicolor and R ² Gt = 0.926 for Gloeophyllun trabeum
Small errors between the experimental and calculated values of two designed compounds indicated that these two QSAR models have strong predictability and stability

Metadata-grounded summary

Citation abstract

Cinnamaldehyde, of the genius Cinnamomum, is a major constituent of the bark of the cinnamon tree and possesses broad-spectrum antimicrobial activity. In this study, we used best multiple linear regression (BMLR) to develop quantitative structure activity relationship (QSAR) models for cinnamaldehyde derivatives against wood-decaying fungi Trametes versicolor and Gloeophyllun trabeum. Based on the two optimal QSAR models, we then designed and synthesized two novel cinnamaldehyde compounds. The QSAR models exhibited good correlation coefficients: R ² Tv = 0.910 for Trametes versicolor and R ² Gt = 0.926 for Gloeophyllun trabeum. Small errors between the experimental and calculated values of two designed compounds indicated that these two QSAR models have strong predictability and stability.

Citation

Yang D, Wang H, Yuan H, Li S (2016). Quantitative Structure Activity Relationship of Cinnamaldehyde Compounds against Wood-Decaying Fungi. Molecules (Basel, Switzerland) https://doi.org/10.3390/molecules21111563 PMID: 27869684

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