4-{2-[4-(2-acetamido-2-deoxy-beta-D-glucopyranosyloxy)-3-methoxyphenyl]-vinyl}-1-methylquinolinium iodide

HCID 67859971

基本情報

標準SMILES: COc1cc(C=Cc2cc[n+](C)c3ccccc23)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1NC(C)=O.[I-]
InChIKey: YFYYWSWXHXCHEY-ZAFMQFAESA-N
分子式: C27H31IN2O7
平均分子量: 622.4 g/mol

優先名称: 4-{2-[4-(2-acetamido-2-deoxy-beta-D-glucopyranosyloxy)-3-methoxyphenyl]-vinyl}-1-methylquinolinium iodide
IUPAC: N-[(2S,3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-[2-methoxy-4-[2-(1-methylquinolin-1-ium-4-yl)ethenyl]phenoxy]oxan-3-yl]acetamide iodide

SCHEMBL9483306YFYYWSWXHXCHEY-ZAFMQFAESA-N4-{2-[4-(2-acetamido-2-deoxy-beta-D-glucopyranosyloxy)-3-methoxyphenyl]-vinyl}-1-methylquinolinium iodide

読み込み中…

標準SMILES: COc1cc(C=Cc2cc[n+](C)c3ccccc23)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1NC(C)=O.[I-]
InChIKey: YFYYWSWXHXCHEY-ZAFMQFAESA-N
分子式: C27H31IN2O7
平均分子量: 622.4 g/mol

優先名称: 4-{2-[4-(2-acetamido-2-deoxy-beta-D-glucopyranosyloxy)-3-methoxyphenyl]-vinyl}-1-methylquinolinium iodide
IUPAC: N-[(2S,3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-[2-methoxy-4-[2-(1-methylquinolin-1-ium-4-yl)ethenyl]phenoxy]oxan-3-yl]acetamide iodide

SCHEMBL9483306YFYYWSWXHXCHEY-ZAFMQFAESA-N4-{2-[4-(2-acetamido-2-deoxy-beta-D-glucopyranosyloxy)-3-methoxyphenyl]-vinyl}-1-methylquinolinium iodide

読み込み中…