MSI_000026716

Unreliable

排名分数: 1.77
参考来源: Mus musculus (UBERON:0002048: lung)

M/z: 807.68
Mass Window: 807.68 ~ 807.68 (none)

参考注释

Sitosterol 3-O-(6'-O-stearyl-beta-D-glucoside)_[M+H-2H2O]+ (BioDeep_00000227490)
[(2R,3S,4S,5R,6R)-6-{[(2R,5S,10S,14R,15R)-14-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-2,15-dimethyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadec-7-en-5-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl octadecanoate

Formula: C53H94O7 (842.6999174)
SMILES:

CCCCCCCCCCCCCCCCCC(=O)OC[C@H]1O[C@@H](O[C@H]2CC[C@]3(C)C4CC[C@]5(C)[C@H](CCC5[C@@H]4CC=C3C2)[C@H](C)CC[C@@H](CC)C(C)C)[C@H](O)[C@@H](O)[C@@H]1O

Sitosterol 3-o-(6-o-stearyl-beta-d-glucoside) is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Sitosterol 3-o-(6-o-stearyl-beta-d-glucoside) can be found in fig, which makes sitosterol 3-o-(6-o-stearyl-beta-d-glucoside) a potential biomarker for the consumption of this food product.