MSI_000000190

Unreliable

排名分数: 1.64
参考来源: Mus musculus (CL:0000066: epithelial cell)

M/z: 686.5962
Mass Window: 686.5962 ~ 686.5962 (none)

参考注释

(1s,3r,6s,7s,8s,11s,12s,15r,16r)-7,12,16-trimethyl-15-[(2r)-6-methyl-5-methylideneheptan-2-yl]pentacyclo[9.7.0.0¹,³.0³,⁸.0¹²,¹⁶]octadecan-6-yl (9z,12z,15z)-octadeca-9,12,15-trienoate_[M]+ (BioDeep_00002147533)
(1s,3r,6s,7s,8s,11s,12s,15r,16r)-7,12,16-trimethyl-15-[(2r)-6-methyl-5-methylideneheptan-2-yl]pentacyclo[9.7.0.0¹,³.0³,⁸.0¹²,¹⁶]octadecan-6-yl (9z,12z,15z)-octadeca-9,12,15-trienoate

Formula: C48H78O2 (686.6001487999999)
SMILES:

C=C(CC[C@@H](C)[C@H]1CC[C@@]2(C)[C@@H]3CC[C@H]4[C@H](C)[C@@H](OC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC)CC[C@@]45C[C@@]35CC[C@]12C)C(C)C