MSI_000053616
Reliable
排名分数: 7.18
参考来源: MALDI - CHCA (NOVOCELL:BACKGROUND: blank)
M/z: 540.0663
Mass Window: 540.0661 ~ 540.067 (3.8 ppm)
参考注释
4,12-dihydroxy-10-{[4'-(sulfooxy)-[1,1'-biphenyl]-3,3'-diyl]oxy}-8-oxatricyclo[7.4.0.0²,⁷]trideca-1(9),2(7),3,5,10,12-hexaene-5-carboxylic acid_[M]+ (BioDeep_00002280238)4,12-dihydroxy-10-{[4'-(sulfooxy)-[1,1'-biphenyl]-3,3'-diyl]oxy}-8-oxatricyclo[7.4.0.0²,⁷]trideca-1(9),2(7),3,5,10,12-hexaene-5-carboxylic acid
Formula: C25H16O12S (540.0362456)
SMILES:
O=C(O)c1cc2oc3c(Oc4ccc(-c5ccc(OS(=O)(=O)O)c(O)c5)cc4O)cc(O)cc3c2cc1O
