MSI_000016047

Unreliable

排名分数: 2.74
参考来源: Vitis vinifera (PO:0009085: exocarp)

M/z: 677.1294
Mass Window: 677.1292 ~ 677.1296 (1.6 ppm)

参考注释

Quercetin 3-O-(6'-malonyl-glucoside) 7-O-glucoside_[M+H-2H2O]+ (BioDeep_00000019105)
3-[(6-{[2-(3,4-dihydroxyphenyl)-5-hydroxy-4-oxo-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4H-chromen-3-yl]oxy}-3,4,5-trihydroxyoxan-2-yl)methoxy]-3-oxopropanoic acid

Formula: C30H32O20 (712.1486872)
SMILES:

c1c(cc(c(c1)O)O)c1oc2c(c(=O)c1O[C@H]1[C@H]([C@H]([C@@H]([C@H](O1)COC(=O)CC(=O)O)O)O)O)c(cc(c2)O[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)CO)O)O)O)O

Quercetin 3-O-(6"-malonyl-glucoside) 7-O-glucoside is found in endive. Quercetin 3-O-(6"-malonyl-glucoside) 7-O-glucoside is a constituent of Ranunculus subgenus Batrachium sp. and red lettuce (Lactuca sativa) [CCD] Constituent of Ranunculus subgenus Batrachium species and red lettuce (Lactuca sativa) [CCD]. Quercetin 3-O-(6"-malonyl-glucoside) 7-O-glucoside is found in endive and lettuce.