HRID1920711

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID2244

Aspirin

C9H8O4

反应SMILES：CC(C)c1nc(N(C)S(C)(=O)=O)nc(-c2ccc(F)cc2)c1/C=C/[C@@H](O)C[C@@H](O)CC(=O)[O-].CC(C)c1nc(N(C)S(C)(=O)=O)nc(-c2ccc(F)cc2)c1/C=C/[C@@H](O)C[C@@H](O)CC(=O)[O-].[Ca+2]

HCID5282455

Rosuvastatin calcium

C44H54CaF2N6O12S2

PRODUCTS

产物

反应SMILES：CC(=O)Oc1ccccc1C(=O)O.CC(C)c1nc(N(C)S(C)(=O)=O)nc(-c2ccc(F)cc2)c1/C=C/[C@@H](O)C[C@@H](O)CC(=O)[O-].CC(C)c1nc(N(C)S(C)(=O)=O)nc(-c2ccc(F)cc2)c1/C=C/[C@@H](O)C[C@@H](O)CC(=O)[O-].[Ca+2]

HCID62705023

未命名化合物

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID702

Ethanol

C2H6O

CONDITIONS

反应条件

温度: 140 °C

PROCEDURE

实验过程

The highly non-crystalline glass state of the combination of rosuvastatin calcium and aspirin was produced by applying a repeated sequence of short wavelength followed by long wavelength laser light modulated and structured by a Strachan Device. A 60 mg sample of rosuvastatin calcium and a 60 mg sample of crystalline aspirin were dissolved in 1200 mg of absolute ethanol by stirring at 9000 rpm with a magnetic stirrer, while heating to 140° C. for 10 minutes in a stoppered Erlenmeyer flask. The solution was filtered, and then divided equally into 6 polystyrene Petri dishes for producing treated and untreated control samples and each sample was covered with a polystyrene lid. The samples were allowed to cool to room temperature.

WORKUP

后处理

filtrationThe solution was filtered
customfor producing
additiontreated
temperatureto cool to room temperature

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-da1b4bd000144fddae18885eaee024b1
来源数据集: uspto-grants-2012_05
DOI: 10.6084/m9.figshare.5104873.v1
专利号: US08173632B2
来源说明: uspto-grants-2012_05

反应SMILES

[CH3:1][CH:2]([CH3:33])[C:3]1[N:4]=[C:5]([N:27]([CH3:32])[S:28]([CH3:31])(=[O:30])=[O:29])[N:6]=[C:7]([C:20]2[CH:25]=[CH:24][C:23]([F:26])=[CH:22][CH:21]=2)[C:8]=1/[CH:9]=[CH:10]/[C@H:11]([CH2:13][C@H:14]([CH2:16][C:17]([O-:19])=[O:18])[OH:15])[OH:12].[CH3:34][CH:35]([CH3:66])[C:36]1[N:37]=[C:38]([N:60]([CH3:65])[S:61]([CH3:64])(=[O:63])=[O:62])[N:39]=[C:40]([C:53]2[CH:58]=[CH:57][C:56]([F:59])=[CH:55][CH:54]=2)[C:41]=1/[CH:42]=[CH:43]/[C@H:44]([CH2:46][C@H:47]([CH2:49][C:50]([O-:52])=[O:51])[OH:48])[OH:45].[Ca+2:67].[CH3:68][C:69]([O:71][C:72]1[CH:73]=[CH:74][CH:75]=[CH:76][C:77]=1[C:78]([OH:80])=[O:79])=[O:70]>C(O)C>[CH3:1][CH:2]([CH3:33])[C:3]1[N:4]=[C:5]([N:27]([CH3:32])[S:28]([CH3:31])(=[O:29])=[O:30])[N:6]=[C:7]([C:20]2[CH:21]=[CH:22][C:23]([F:26])=[CH:24][CH:25]=2)[C:8]=1/[CH:9]=[CH:10]/[C@H:11]([CH2:13][C@H:14]([CH2:16][C:17]([O-:19])=[O:18])[OH:15])[OH:12].[CH3:34][CH:35]([CH3:66])[C:36]1[N:37]=[C:38]([N:60]([CH3:65])[S:61]([CH3:64])(=[O:62])=[O:63])[N:39]=[C:40]([C:53]2[CH:54]=[CH:55][C:56]([F:59])=[CH:57][CH:58]=2)[C:41]=1/[CH:42]=[CH:43]/[C@H:44]([CH2:46][C@H:47]([CH2:49][C:50]([O-:52])=[O:51])[OH:48])[OH:45].[Ca+2:67].[CH3:68][C:69]([O:71][C:72]1[CH:73]=[CH:74][CH:75]=[CH:76][C:77]=1[C:78]([OH:80])=[O:79])=[O:70]