MSI_000016468

Unreliable

排名分数: 0.9
参考来源: Vitis vinifera (PO:0009086: endocarp)

M/z: 309.0603
Mass Window: 309.0603 ~ 309.0603 (0.1 ppm)

参考注释

Theogallin_[M+H-2H2O]+ (BioDeep_00000008347)
1,3,4-trihydroxy-5-(3,4,5-trihydroxybenzoyloxy)cyclohexane-1-carboxylic acid

Formula: C14H16O10 (344.0743436)
SMILES: c1(c(c(cc(c1)C(=O)O[C@@H]1C[C@](C[C@H]([C@H]1O)O)(O)C(=O)O)O)O)O

Theogallin is found in blackcurrant. Theogallin is isolated from tea.