27468-20-8
中文名称
脱氧基新隐丹参酮
英文名称
5,6,7,8-Tetrahydro-3-hydroxy-2-isopropyl-8,8-dimethyl-1,4-phenanthrenedione
CAS
27468-20-8
分子式
C19H22O3
分子量
298.38
MOL 文件
27468-20-8.mol
更新日期
2024/10/30 16:49:03
27468-20-8 结构式
基本信息
中文别名
新隐丹参酮II去羟新隐丹参酮
脱氧基新隐丹参酮
脱氧基新隐丹参酮/新隐丹参酮II
英文别名
Neocryptotanshinone ⅡDeoxyneocryptotanshinone
5,6,7,8-Tetrahydro-3-hydroxy-2-isopropyl-8,8-dimethyl-1,4-phenanthrenedione
1,4-Phenanthrenedione, 5,6,7,8-tetrahydro-3-hydroxy-2-isopropyl-8,8-dimethyl-
1,4-Phenanthrenedione, 5,6,7,8-tetrahydro-3-hydroxy-8,8-dimethyl-2-(1-methylethyl)-
所属类别
天然产物：醌类物理化学性质
沸点468.0±45.0 °C(Predicted)
密度1.179±0.06 g/cm3(Predicted)
溶解度Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc.
酸度系数(pKa)4.50±1.00(Predicted)
形态粉末
InChIInChI=1S/C19H22O3/c1-10(2)14-16(20)12-7-8-13-11(6-5-9-19(13,3)4)15(12)18(22)17(14)21/h7-8,10,21H,5-6,9H2,1-4H3
InChIKeyBIDSIGUBHQOWEC-UHFFFAOYSA-N
SMILESC1(=O)C2=C(C3=C(C=C2)C(C)(C)CCC3)C(=O)C(O)=C1C(C)C