MSI_000017900

Reliable

排名分数: 1.11
参考来源: Vitis vinifera (PO:0009087: mesocarp)

M/z: 554.0223
Mass Window: 554.0223 ~ 554.0223 (0.2 ppm)

参考注释

16-chloro-17-(dichloromethyl)-4,10-dihydroxy-6,15-dimethoxy-6-methyl-7-oxapentacyclo[11.8.0.0³,¹¹.0⁵,⁹.0¹⁴,¹⁹]henicosa-1(21),3,5(9),10,13,15,17,19-octaene-2,8,12-trione_[M+NH4]+ (BioDeep_00002243619)
16-chloro-17-(dichloromethyl)-4,10-dihydroxy-6,15-dimethoxy-6-methyl-7-oxapentacyclo[11.8.0.0³,¹¹.0⁵,⁹.0¹⁴,¹⁹]henicosa-1(21),3,5(9),10,13,15,17,19-octaene-2,8,12-trione

Formula: C24H15Cl3O8 (535.983248)
SMILES: COc1c(Cl)c(C(Cl)Cl)cc2ccc3c(c12)C(=O)c1c(O)c2c(c(O)c1C3=O)C(C)(OC)OC2=O