CAS: 150821-16-2; (4As,6As,6Br,8Ar,9S,10S,11R,12Ar,12Br,14Bs)-10,11-Dihydroxy-9-(Hydroxymethyl)-2,2,6A,6B,9,12A-Hexamethyl-1,3,4,5,6,6A,6B,7,8,8A,9,10,11,12,12A,12B,13,14B-Octadecahydropicene-4A(2H)-Carboxylic Acid

该化合物是一种三叶质化合物,具有氢氧油质骨质的特性,其结构特征,包括位于第2,3和23号阵地的三个氢氧基组,以及位于C-28号阵地的一个碳信箱组,有助于其潜在的生物活性和溶性特征.界定的立体化学(2α,3α,4β)确保分子相互作用的一致性,使其对医学化学和自然产品研究具有价值.这一化合物具有意义,因为它在调节生物途径方面可能发挥的作用,如反炎或代谢条例.高纯度和精密结构支持将其用作一个参考标准或合成应用的中间体.

英文名称(4As,6As,6Br,8Ar,9S,10S,11R,12Ar,12Br,14Bs)-10,11-Dihydroxy-9-(Hydroxymethyl)-2,2,6A,6B,9,12A-Hexamethyl-1,3,4,5,6,6A,6B,7,8,8A,9,10,11,12,12A,12B,13,14B-Octadecahydropicene-4A(2H)-Carboxylic Acid
中文名称2α,3α,24-三羟基-12-烯-28-齐墩果酸
IUPAC名称(4aS,6aS,6bR,8aR,9S,10S,11R,12aR,12bR,14bS)-10,11-dihydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-octadecahydropicene-4a(2H)-carboxylic acid
其它别名2,3,24-Trihydroxyolean-12-En-28-Oic Acid; 2Alpha,3Alpha,24-Trihydroxyolean-12-En-28-Oic Acid; 2α,3α,24-Trihydroxyolean-12-En-28-Oic Acid; 24-Trihydroxyolean-12-En-28-Oic Acid; (4As,6As,6Br,8Ar,9S,10S,11R,12Ar,12Br,14Bs)-10,11-Dihydroxy-9-(Hydroxymethyl)-2,2,6A,6B,9,12A-Hexamethyl-1,3,4,5,6,6A,6B,7,8,8A,9,10,11,12,12A,12B,13,14B-Octadecahydropicene-4A(2H)-Carboxylicaci; 2Alpha, 3Alpha, 24-Trihydroxy-12-En-28-Neneneba Oleanolic Acid
CAS编号150821-16-2
MFCD编号:MFCD20260560
分子式:C30H48O5分子量:488.71
产品CID: 733224
产品分类天然产物 → 萜类

相似结构搜索
InChIKey: RWNHLTKFBKYDOJ-ZDNZHVAWSA-N
InChI=1S/C30H48O5/c1-25(2)11-13-30(24(34)35)14-12-28(5)18(19(30)15-25)7-8-22-26(3)16-20(32)23(33)27(4,17-31)21(26)9-10-29(22,28)6/h7,19-23,31-33H,8-17H2,1-6H3,(H,34,35)/t
计算化学: 氢键受体数5.0氢键供体数4.0可旋转键数2.0

MSDS等安全信息

危险描述H303May be harmful if swallowed+H313Skin contact may be harmful+H333Inhalation may be harmful to the body
防范说明P264+P280+P305+P351+P338+P337+P313
安全声明H303+H313+H333

上下游产品

2)-β-D-glucopyranosyl>-bayogenin3-O-α-L-arabinopyranosyl(1-2)-β-D-glucopyranosyl-bayogenin lobatoside C undeca-acetate of medicoside J 3-O-β-D-glucopyranosyl-2β,3β,23-trihydroxyolean-12-en-28-oic acid-28-O-β-D-xylopyranosyl-(1->6)-[β-D-glucopyranosyl-(1->2)]-[β-D-glucopyranosyl-(1->3)]-β-D-glucopyranoside bayogenin triacetate olean-12-ene-2β,3β,23,28-tetraol 2α,3β,23-trihydroxyolean-12-en-28-oic acid methyl ester