MSI_000031457

Unreliable

排名分数: 0.69
参考来源: Macropus giganteus (UBERON:0006093: precuneus cortex)

M/z: 676.3098
Mass Window: 676.3098 ~ 676.3098 (none)

参考注释

(8S,9R,11S,13S,14S,17S)-13-Methyl-11-[4-[5-(4,4,5,5,5-pentafluoropentylsulfonyl)pentoxy]phenyl]-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol_[M+NH4]+ (BioDeep_00000185220)
(8S,9R,11S,13S,14S,17S)-13-Methyl-11-[4-[5-(4,4,5,5,5-pentafluoropentylsulphonyl)pentoxy]phenyl]-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol

Formula: C34H43F5O5S (658.2751208)
SMILES: CC12CC(C3C(C1CCC2O)CCC4=C3C=CC(=C4)O)C5=CC=C(C=C5)OCCCCCS(=O)(=O)CCCC(C(F)(F)F)(F)F