HRID233499

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6395

Methanesulfonic acid

CH4O3S

结构：CC(=O)SCC(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@H](O)[C@@H](N5CCOC(C)(C)C5)C[C@]4(C)[C@H]3C(=O)C[C@]12C

HCID10577865

未命名化合物

PRODUCTS

生成物

结构：CC(=O)SCC(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@H](O)[C@@H](N5CCOC(C)(C)C5)C[C@]4(C)[C@H]3C(=O)C[C@]12C.CS(=O)(=O)O

HCID88359628

未命名化合物

PROCEDURE

实验过程

With the 21-(acetylthio) compound of Example 3 and methanesulfonic acid as starting materials, (2β,3α,5α)-21-(acetylthio)-3-hydroxy-2-(2,2-dimethyl-4-morpholinyl)pregnane-11,20-dione methanesulfonate (1:1) salt was formed. [α]D +110° (c 0.8).

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0f678fdd750b4516afede726c6059336
来源数据集: uspto-grants-1997_01
DOI: 10.6084/m9.figshare.5104873.v1
专利: US05593983
来源说明: uspto-grants-1997_01

反应 SMILES

[C:1]([S:4][CH2:5][C:6](=[O:36])[C@@H:7]1[C@:24]2([CH3:25])[C@H:10]([C@H:11]3[C@H:21]([C:22](=[O:26])[CH2:23]2)[C@:19]2([CH3:20])[C@H:14]([CH2:15][C@H:16]([OH:35])[C@@H:17]([N:27]4[CH2:32][CH2:31][O:30][C:29]([CH3:34])([CH3:33])[CH2:28]4)[CH2:18]2)[CH2:13][CH2:12]3)[CH2:9][CH2:8]1)(=[O:3])[CH3:2].[CH3:37][S:38]([OH:41])(=[O:40])=[O:39]>>[CH3:37][S:38]([OH:41])(=[O:40])=[O:39].[C:1]([S:4][CH2:5][C:6](=[O:36])[C@@H:7]1[C@:24]2([CH3:25])[C@H:10]([C@H:11]3[C@H:21]([C:22](=[O:26])[CH2:23]2)[C@:19]2([CH3:20])[C@H:14]([CH2:15][C@H:16]([OH:35])[C@@H:17]([N:27]4[CH2:32][CH2:31][O:30][C:29]([CH3:34])([CH3:33])[CH2:28]4)[CH2:18]2)[CH2:13][CH2:12]3)[CH2:9][CH2:8]1)(=[O:3])[CH3:2]