2613-86-7
中文名稱
4-O-阿魏?？崴?
英文名稱
4-O-Feruloylquinic acid
CAS
2613-86-7
分子式
C17H20O9
分子量
368.34
MOL 文件
2613-86-7.mol
更新日期
2025/08/11 09:42:16
2613-86-7 結(jié)構(gòu)式
基本信息
中文別名
4-O-阿魏?？鼘幩?BR>4-O-阿魏酸奎寧酸4-O-阿魏酸奎尼酸
4-O-阿魏?？崴?BR>4-O-阿魏?；鼘幩?/span>
英文別名
4-Feruoylquinic acid4-Feruloylquinic acid
4-O-Feruloylquinic acid
4-O-feruloyl-D-quinic acid
4-O-Feruloylquinic Acid DISCONTINUED. Please see F308985.
Cyclohexanecarboxylic acid, 1,3,5-trihydroxy-4-[[3-(4-hydroxy-3-methoxyphenyl)-1-oxo-2-propen-1-yl]oxy]-, (1α,3R,4α,5R)-
(1alpha,3R,4alpha,5R)-1,3,5-Trihydroxy-4-[[3-(4-hydroxy-3-methoxyphenyl)-1-oxo-2-propen-1-yl]oxy]cyclohexanecarboxylic acid
所屬類別
有機(jī)原料：羧酸類化合物及衍生物物理化學(xué)性質(zhì)
熔點(diǎn)195-196 °C(Solv: water (7732-18-5))
沸點(diǎn)656.1±55.0 °C(Predicted)
密度1.53±0.1 g/cm3(Predicted)
儲存條件2-8°C
酸度系數(shù)(pKa)4.07±0.50(Predicted)
形態(tài)Solid
顏色White to off-white
InChIInChI=1/C17H20O9/c1-25-13-6-9(2-4-10(13)18)3-5-14(21)26-15-11(19)7-17(24,16(22)23)8-12(15)20/h2-6,11-12,15,18-20,24H,7-8H2,1H3,(H,22,23)/t11-,12-,15-,17+/s3
InChIKeyVTMFDSJJVNQXLT-YYJRJVKZNA-N
SMILESO([C@@H]1[C@@H](C[C@@](O)(C(=O)O)C[C@H]1O)O)C(=O)C=CC1C=CC(O)=C(OC)C=1 |&1:1,2,4,10,r|