HRID2413954

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID13695066

Benzenebutanoic acid, 4-hydroxy-γ-oxo-, methyl ester

C11H12O4

结构：CCCc1c(O[C@H]2CCC[C@H](Oc3ccc(CC(=O)O)cc3Br)C2)ccc(C(C)=O)c1O

HCID70410054

未命名化合物

结构：CCCc1c(O[C@@H]2CCC[C@H](OS(C)(=O)=O)C2)ccc(C(C)=O)c1O

HCID88643326

未命名化合物

PRODUCTS

生成物

结构：CCCc1c(O[C@@H]2CCC[C@H](Oc3ccc(CC(=O)OC)cc3)C2)ccc(C(C)=O)c1O

HCID70409869

未命名化合物

PROCEDURE

实验过程

By following Step A of Example 10, but substituting para-hydroxybenzeneacetic acid methyl ester for 4-(4-hydroxyphenyl)-4-oxobutyric acid methyl ester and substituting the title compound of Step D of Example 8 for the title compound of Step C of Example 8, the title compound of this step was obtained as an oil.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5014e568d6684f6ba8eb6af27f55ef08
来源数据集: uspto-grants-1988_01
DOI: 10.6084/m9.figshare.5104873.v1
专利: US04720505
来源说明: uspto-grants-1988_01

反应 SMILES

[CH3:1]OC(=O)CCC(C1C=CC(O)=CC=1)=O.[C:16]([C:19]1[CH:43]=[CH:42][C:22]([O:23][C@H:24]2[CH2:29][CH2:28][CH2:27][C@H:26]([O:30][C:31]3[CH:36]=[CH:35][C:34]([CH2:37][C:38]([OH:40])=[O:39])=[CH:33][C:32]=3Br)[CH2:25]2)=[C:21]([CH2:44][CH2:45][CH3:46])[C:20]=1[OH:47])(=[O:18])[CH3:17].C(C1C=CC(O[C@@H]2CCC[C@H](OS(C)(=O)=O)C2)=C(CCC)C=1O)(=O)C>>[C:16]([C:19]1[CH:43]=[CH:42][C:22]([O:23][C@@H:24]2[CH2:29][CH2:28][CH2:27][C@H:26]([O:30][C:31]3[CH:36]=[CH:35][C:34]([CH2:37][C:38]([O:40][CH3:1])=[O:39])=[CH:33][CH:32]=3)[CH2:25]2)=[C:21]([CH2:44][CH2:45][CH3:46])[C:20]=1[OH:47])(=[O:18])[CH3:17]