MSI_000017719

Reliable

排名分数: 1.6
参考来源: Vitis vinifera (PO:0009087: mesocarp)

M/z: 583.0824
Mass Window: 583.0824 ~ 583.0824 (0.3 ppm)

参考注释

4,5-dihydroxy-2-methyl-6-({7,13,14-trihydroxy-3,10-dioxo-2,9-dioxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(15),4(16),5,7,11,13-hexaen-6-yl}oxy)oxan-3-yl 3,4,5-trihydroxybenzoate_[M+H-H2O]+ (BioDeep_00002192386)
4,5-dihydroxy-2-methyl-6-({7,13,14-trihydroxy-3,10-dioxo-2,9-dioxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(15),4(16),5,7,11,13-hexaen-6-yl}oxy)oxan-3-yl 3,4,5-trihydroxybenzoate

Formula: C27H20O16 (600.075132)
SMILES: CC1OC(Oc2cc3c(=O)oc4c(O)c(O)cc5c(=O)oc(c2O)c3c45)C(O)C(O)C1OC(=O)c1cc(O)c(O)c(O)c1