MSI_000017304

Reliable

排名分数: 3.13
参考来源: Vitis vinifera (PO:0009087: mesocarp)

M/z: 468.0619
Mass Window: 468.0619 ~ 468.0619 (0.2 ppm)

参考注释

[(z)-(6-methanesulfonyl-1-{[(2r,3r,4s,5r,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanyl}hexylidene)amino]oxysulfonic acid_[M+H]+ (BioDeep_00002252828)
[(z)-(6-methanesulfonyl-1-{[(2r,3r,4s,5r,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanyl}hexylidene)amino]oxysulfonic acid

Formula: C13H25NO11S3 (467.05897)
SMILES: CS(=O)(=O)CCCCC/C(=N/OS(=O)(=O)O)S[C@H]1O[C@@H](CO)[C@H](O)[C@H](O)[C@H]1O