3-epi-6-deoxocathasterone
IUPAC 名称
14-(3-hydroxy-5,6-dimethylheptan-2-yl)-2,15-dimethyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadecan-5-ol
描述
3-epi-6-deoxocathasterone belongs to dihydroxy bile acids, alcohols and derivatives class of compounds. Those are compounds containing or derived from a bile acid or alcohol, and which bears exactly two carboxylic acid groups. 3-epi-6-deoxocathasterone is practically insoluble (in water) and an extremely weak acidic compound (based on its pKa). 3-epi-6-deoxocathasterone can be found in a number of food items such as butternut, mung bean, sunflower, and japanese persimmon, which makes 3-epi-6-deoxocathasterone a potential biomarker for the consumption of these food products.
异构
CC(C)C(C)CC(O)C(C)C1CCC2C3CCC4CC(O)CCC4(C)C3CCC12C
InChI标识符
InChI=1S/C28H50O2/c1-17(2)18(3)15-26(30)19(4)23-9-10-24-22-8-7-20-16-21(29)11-13-27(20,5)25(22)12-14-28(23,24)6/h17-26,29-30H,7-16H2,1-6H3
键
ZHZKWZJLUNXOSN-UHFFFAOYSA-N