备 注:
英文名称:2,2’-Cyclouridine
CAS号:3736-77-4
分子式:C9H10N2O5
分子量:226.19
EINECS号:223-107-6
MDL No.:MFCD00004945
熔点248-251 °C(lit.)
比旋光度-21°(19℃, c=4, H2O)
沸点456.3±55.0 °C(Predicted)
密度2.01±0.1 g/cm3(Predicted)
折射率-20 ° (C=4, H2O)
储存条件-20°C
溶解度DMSO:2.0(Max Conc. mg/mL);8.84(Max Conc. mM)
PBS (pH:7.2):1.0(Max Conc. mg/mL);4.42(Max Conc. mM)
酸度系数(pKa)12.55±0.40(Predicted)
形态powder to crystal
颜色White to Almost white
旋光性 (optical activity)[α]19/D 21°, c = 4 in H2O
InChIInChI=1S/C9H10N2O5/c12-3-4-6(14)7-8(15-4)11-2-1-5(13)10-9(11)16-7/h1-2,4,6-8,12,14H,3H2/t4-,6-,7+,8-/m1/s1
InChIKeyUUGITDASWNOAGG-CCXZUQQUSA-N
SMILESC12O[C@@]3([H])[C@H](O)[C@@H](CO)O[C@@]3([H])N1C=CC(=O)N=2