2alpha,3alpha-Dihydroxyolean-12-en-28-oic acid
IUPAC 名称
(4aS,6aS,6bR,10S,11R,12aR,12bR,14bR)-10,11-dihydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-4a-carboxylic acid
描述
2alpha,3alpha-dihydroxyolean-12-en-28-oic acid, also known as 2α,3α-dihydroxyolean-12-en-28-oate, is a member of the class of compounds known as triterpenoids. Triterpenoids are terpene molecules containing six isoprene units. 2alpha,3alpha-dihydroxyolean-12-en-28-oic acid is practically insoluble (in water) and a weakly acidic compound (based on its pKa). 2alpha,3alpha-dihydroxyolean-12-en-28-oic acid can be found in common sage, which makes 2alpha,3alpha-dihydroxyolean-12-en-28-oic acid a potential biomarker for the consumption of this food product.
异构
[H][C@@]1(O)C[C@@]2(C)C([H])(CC[C@]3(C)[C@]2([H])CC=C2[C@@]4([H])CC(C)(C)CC[C@@]4(CC[C@@]32C)C(O)=O)C(C)(C)[C@]1([H])O
InChI标识符
InChI=1S/C30H48O4/c1-25(2)12-14-30(24(33)34)15-13-28(6)18(19(30)16-25)8-9-22-27(5)17-20(31)23(32)26(3,4)21(27)10-11-29(22,28)7/h8,19-23,31-32H,9-17H2,1-7H3,(H,33,34)/t19-,20-,21?,22-,23-,27+,28-,29-,30+/m1/s1
键
MDZKJHQSJHYOHJ-LJJNEPIXSA-N