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金雞納鹼戊酸鹽
quinine valerate
戊酸奎寧, einecs 208-975-6, ccris 5759
CAS号: 549-66-6
IUPAC名称: (R)-[(2S,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol;pentanoic acid
分子式: C25H34N2O4
分子量: 426.54800
InChI: InChI=1S/C20H24N2O2.C5H10O2/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18;1-2-3-4-5(6)7/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3;2-4H2,1H3,(H,6,7)/t13-,14-,19-,20+;/m0./s1
InChIKey: YSJITFFVRIOVOZ-DSXUQNDKSA-N
SMILES: CCCCC(=O)O.COC1=CC2=C(C=CN=C2C=C1)[C@H]([C@@H]3C[C@@H]4CCN3C[C@@H]4C=C)O
EINECS: -
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