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24394-09-0

中文名稱 薊苦素
英文名稱 CNICIN
CAS 24394-09-0
分子式 C20H26O7
分子量 378.42
MOL 文件 24394-09-0.mol
24394-09-0 結(jié)構(gòu)式 24394-09-0 結(jié)構(gòu)式

基本信息

英文別名
CNICIN
CYNISIN
cnicine
CENTAURIN
Aids104627
Aids-104627
-lactone,8-(3,4-dihydroxy-2-methylenebutyrate)
2,3,3a,4,5,8,9,11a-octahydro-10-(hydroxymethyl)-6-methyl-3-methylene-2-oxocyclodeca[b]furan-4-yl 3,4-dihydroxy-2-methylenebutyrate
3,4-Dihydroxy-2-methylenebutanoic acid 2,3,3A,4,5,8,9,11A-octahydro-10-(hydroxymethyl)-6-methyl-3-methylene-2-oxocyclodeca[B]furan-4-yl ester
(3R)-3,4-Dihydroxy-2-methylenebutyric acid (3aR,4S,6E,10Z,11aR)-2,3,3a,4,5,8,9,11a-octahydro-10-(hydroxymethyl)-6-methyl-3-methylene-2-oxocyclodeca[b]furan-4-yl ester

物理化學(xué)性質(zhì)

熔點142-143°C
比旋光度D20 +158° (c = 2.3 in ethanol)
沸點622.3±55.0 °C(Predicted)
密度1.27±0.1 g/cm3 (20 ºC 760 Torr)
酸度系數(shù)(pKa)12.77±0.20(Predicted)
形態(tài)Solid
顏色White to off-white
LogP2.320 (est)

安全數(shù)據(jù)

危險性符號(GHS)GHS hazard pictograms
GHS07
警示詞警告
危險性描述H302-H315-H319-H335
安全說明22-24/25
毒性mouse,LD50,oral,452mg/kg (452mg/kg),Planta Medica. Vol. 53, Pg. 247, 1987.
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