MSI_000000305

Unreliable

排名分数: 0.91
参考来源: Mus musculus (CL:0000066: epithelial cell)

M/z: 848.5532
Mass Window: 848.5532 ~ 848.5532 (none)

参考注释

(2s,3e,6e,8s)-8-[(2s,7r,8r,9s)-9-hydroxy-2-[(2r,4s,7r,10s)-2-[(2s,3s,5r,6s)-6-hydroxy-3,5,6-trimethyloxan-2-yl]-10-({[(2r,5s,6r)-5-methoxy-6-methyloxan-2-yl]oxy}methyl)-4-methyl-1,6-dioxaspiro[4.5]decan-7-yl]-2,8-dimethyl-1,6-dioxaspiro[4.5]decan-7-yl]-2,4,6-trimethyl-5-oxonona-3,6-dienoic acid_[M]+ (BioDeep_00002166378)
(2s,3e,6e,8s)-8-[(2s,7r,8r,9s)-9-hydroxy-2-[(2r,4s,7r,10s)-2-[(2s,3s,5r,6s)-6-hydroxy-3,5,6-trimethyloxan-2-yl]-10-({[(2r,5s,6r)-5-methoxy-6-methyloxan-2-yl]oxy}methyl)-4-methyl-1,6-dioxaspiro[4.5]decan-7-yl]-2,8-dimethyl-1,6-dioxaspiro[4.5]decan-7-yl]-2,4,6-trimethyl-5-oxonona-3,6-dienoic acid

Formula: C47H76O13 (848.5285646)
SMILES:

CO[C@H]1CC[C@H](OC[C@@H]2CC[C@H]([C@]3(C)CCC4(C[C@H](O)[C@@H](C)[C@@H]([C@@H](C)/C=C(\C)C(=O)/C(C)=C/[C@H](C)C(=O)O)O4)O3)OC23O[C@@H]([C@H]2O[C@](C)(O)[C@H](C)C[C@@H]2C)C[C@@H]3C)O[C@@H]1C