MSI_000015664

Unreliable

排名分数: 3.73
参考来源: Vitis vinifera (PO:0009085: exocarp)

M/z: 556.0805
Mass Window: 556.0805 ~ 556.0805 (0.2 ppm)

参考注释

(20e)-4,6,23-trichloro-13-methoxypentacyclo[20.2.2.1¹⁰,¹⁴.1¹⁵,¹⁹.0²,⁷]octacosa-1(25),2,4,6,10,12,14(28),15(27),16,18,20,22(26),23-tridecaene-5,16,24-triol_[M+NH4]+ (BioDeep_00002077008)
(20e)-4,6,23-trichloro-13-methoxypentacyclo[20.2.2.1¹⁰,¹⁴.1¹⁵,¹⁹.0²,⁷]octacosa-1(25),2,4,6,10,12,14(28),15(27),16,18,20,22(26),23-tridecaene-5,16,24-triol

Formula: C29H21Cl3O4 (538.0505356)
SMILES: COc1ccc2cc1-c1cc(ccc1O)/C=C/c1ccc(c(O)c1Cl)-c1cc(Cl)c(O)c(Cl)c1CC2