MSI_000016736

Unreliable

排名分数: 0.11
参考来源: Vitis vinifera (PO:0009086: endocarp)

M/z: 450.0523
Mass Window: 450.0522 ~ 450.0523 (0.4 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-H2O]+ (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