MSI_000016042
Unreliable
排名分数: 2.77
参考来源: Vitis vinifera (PO:0009085: exocarp)
M/z: 565.0268
Mass Window: 565.0267 ~ 565.0268 (0.4 ppm)
参考注释
Theograndin I_[M+Na]+ (BioDeep_00000245464)Theograndin I
Formula: C21H18O15S (542.0366398)
SMILES:
O=C(O)C1OC(Oc2c(O)cc(O)c3c(=O)cc(-c4ccc(O)cc4)oc23)C(O)C(OS(=O)(=O)O)C1O