MSI_000009229

Unreliable

排名分数: 2.81
参考来源: Mus musculus (UBERON:0004645: urinary bladder urothelium)

M/z: 798.5815
Mass Window: 798.5815 ~ 798.5815 (none)

参考注释

[(1r,2r,6s,7s,8r,10s,11s,12r,14s,16r,18r)-6,7-dihydroxy-4,18-dimethyl-5-oxo-16-(prop-1-en-2-yl)-14-undecyl-9,13,15,19-tetraoxahexacyclo[12.4.1.0¹,¹¹.0²,⁶.0⁸,¹⁰.0¹²,¹⁶]nonadec-3-en-8-yl]methyl hexadecanoate_[M]+ (BioDeep_00002070582)
[(1r,2r,6s,7s,8r,10s,11s,12r,14s,16r,18r)-6,7-dihydroxy-4,18-dimethyl-5-oxo-16-(prop-1-en-2-yl)-14-undecyl-9,13,15,19-tetraoxahexacyclo[12.4.1.0¹,¹¹.0²,⁶.0⁸,¹⁰.0¹²,¹⁶]nonadec-3-en-8-yl]methyl hexadecanoate

Formula: C48H78O9 (798.5645538)
SMILES:

C=C(C)[C@]12C[C@@H](C)[C@@]34O[C@](CCCCCCCCCCC)(O[C@@H]1[C@@H]3[C@@H]1O[C@]1(COC(=O)CCCCCCCCCCCCCCC)[C@@H](O)[C@]1(O)C(=O)C(C)=C[C@H]14)O2