MSI_000015654

Unreliable

排名分数: 3.77
参考来源: Vitis vinifera (PO:0009085: exocarp)

M/z: 572.0471
Mass Window: 572.047 ~ 572.0471 (0.1 ppm)

参考注释

(2s,3s,4r,5s,6s)-3,4,5-trihydroxy-6-{[5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxo-7-(sulfooxy)chromen-3-yl]oxy}oxane-2-carboxylic acid_[M]+ (BioDeep_00002213912)
(2s,3s,4r,5s,6s)-3,4,5-trihydroxy-6-{[5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxo-7-(sulfooxy)chromen-3-yl]oxy}oxane-2-carboxylic acid

Formula: C22H20O16S (572.0472040000001)
SMILES: COc1cc(-c2oc3cc(OS(=O)(=O)O)cc(O)c3c(=O)c2O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@@H](O)[C@@H]2O)ccc1O