MSI_000006562

Reliable

排名分数: 5.03
参考来源: Rattus norvegicus (UBERON:0004358: caput epididymis)

M/z: 544.3172
Mass Window: 544.317 ~ 544.3178 (3.2 ppm)

参考注释

Iganidipine_[M+NH4]+ (BioDeep_00000179943)
3-{2,2-dimethyl-3-[4-(prop-2-en-1-yl)piperazin-1-yl]propyl} 5-methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid

Formula: C28H38N4O6 (526.2791208)
SMILES: COC(=O)C1=C(C)NC(C)=C(C1C1=CC(=CC=C1)[N+]([O-])=O)C(=O)OCC(C)(C)CN1CCN(CC=C)CC1