MSI_000049666

Unreliable

排名分数: 1.69
参考来源: Mytilus edulis (UBERON:0009120: gill filament)

M/z: 465.3532
Mass Window: 465.3532 ~ 465.3532 (none)

参考注释

Castasterone_[M+H]+ (BioDeep_00000010920)
(2R,3S,5S,8S,9S,10R,13S,14S,17R)-17-[(2S,3R,4R,5S)-3,4-dihydroxy-5,6-dimethyl-heptan-2-yl]-2,3-dihydroxy-10,13-dimethyl-1,2,3,4,5,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-6-one

Formula: C28H48O5 (464.3501558)
SMILES:

[C@]12(CC(=O)[C@@]3([H])C[C@H](O)[C@H](O)C[C@]3(C)[C@@]1([H])CC[C@]1(C)[C@@]([H])([C@@](C)([H])[C@@H](O)[C@H](O)[C@@H](C)C(C)C)CC[C@@]21[H])[H]