MSI_000053806

Reliable

排名分数: 4.38
参考来源: MALDI - CHCA (NOVOCELL:BACKGROUND: blank)

M/z: 551.0147
Mass Window: 551.0146 ~ 551.015 (1.7 ppm)

参考注释

3-[(2e)-2-[(sulfooxy)imino]-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanyl}ethyl]indole-1-sulfonic acid_[M+Na]+ (BioDeep_00002234405)
3-[(2e)-2-[(sulfooxy)imino]-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanyl}ethyl]indole-1-sulfonic acid

Formula: C16H20N2O12S3 (528.017836)
SMILES: O=S(=O)(O)O/N=C(\Cc1cn(S(=O)(=O)O)c2ccccc12)SC1OC(CO)C(O)C(O)C1O