MSI_000053591

Reliable

排名分数: 8.08
参考来源: MALDI - CHCA (NOVOCELL:BACKGROUND: blank)

M/z: 462.0556
Mass Window: 462.0552 ~ 462.056 (3.2 ppm)

参考注释

[(e)-[(4r)-4-hydroxy-7-methanesulfonyl-1-{[(2r,3r,4r,5r,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanyl}heptylidene]amino]oxysulfonic acid_[M+H-2H2O]+ (BioDeep_00002181204)
[(e)-[(4r)-4-hydroxy-7-methanesulfonyl-1-{[(2r,3r,4r,5r,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanyl}heptylidene]amino]oxysulfonic acid

Formula: C14H27NO12S3 (497.0695342)
SMILES: CS(=O)(=O)CCC[C@@H](O)CC/C(=N\OS(=O)(=O)O)S[C@H]1O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]1O