MSI_000011673

Unavailable

排名分数: -1.98
参考来源: Mus musculus (UBERON:0012378: muscle layer of urinary bladder)

M/z: 946.618
Mass Window: 946.618 ~ 946.618 (none)

参考注释

14,35-dimethyl (3s,8s,11s,14r,16r,17s,20r,24s,29r,32s,33r,35r,38s,41r,42s)-24-hydroxy-3,8,11,14,17,20,29,32,35,38,41,46-dodecamethyl-23-oxo-2,25-dioxaundecacyclo[24.20.0.0³,²⁴.0⁴,²¹.0⁷,²⁰.0⁸,¹⁷.0¹¹,¹⁶.0²⁸,⁴⁵.0²⁹,⁴².0³²,⁴¹.0³³,³⁸]hexatetraconta-1(46),4,6,21,26,28(45),43-heptaene-14,35-dicarboxylate_[M+NH4]+ (BioDeep_00002126923)
14,35-dimethyl (3s,8s,11s,14r,16r,17s,20r,24s,29r,32s,33r,35r,38s,41r,42s)-24-hydroxy-3,8,11,14,17,20,29,32,35,38,41,46-dodecamethyl-23-oxo-2,25-dioxaundecacyclo[24.20.0.0³,²⁴.0⁴,²¹.0⁷,²⁰.0⁸,¹⁷.0¹¹,¹⁶.0²⁸,⁴⁵.0²⁹,⁴².0³²,⁴¹.0³³,³⁸]hexatetraconta-1(46),4,6,21,26,28(45),43-heptaene-14,35-dicarboxylate

Formula: C60H80O8 (928.5852880000001)
SMILES:

COC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=CC(=O)[C@@]6(O)Oc7cc8c(c(C)c7O[C@@]56C)C=C[C@@H]5[C@@]8(C)CC[C@@]6(C)[C@@H]7C[C@](C)(C(=O)OC)CC[C@]7(C)CC[C@]56C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1