HRID2090250

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID1118

Sulfuric acid

H2O4S

结构：CCCCc1nc2c(N)nc3ccccc3c2n1CCCN(Cc1ccc(CC(=O)O)cc1)C1CCN(C)CC1

HCID68431610

未命名化合物

PRODUCTS

生成物

结构：CCCCc1nc2c(N)nc3ccccc3c2n1CCCN(Cc1ccc(CC(=O)OC)cc1)C1CCN(C)CC1

HCID25106691

未命名化合物

PROCEDURE

实验过程

Sulfuric acid (1 mL) was added to the product from step (i) (250 mg) in MeOH (10 mL). The mixture was stirred at rt for 15 h, then the solvent evaporated under reduced pressure. The residue was purified by RPHPLC to afford the title compound, yield 6.2 mg.

WORKUP

后处理

customthe solvent evaporated under reduced pressure
customThe residue was purified by RPHPLC

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-972886bb661a48428f3f5ca71c52adaa
来源数据集: uspto-grants-2013_05
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08436178B2
来源说明: uspto-grants-2013_05

反应 SMILES

S(=O)(=O)(O)O.[NH2:6][C:7]1[C:16]2[N:17]=[C:18]([CH2:42][CH2:43][CH2:44][CH3:45])[N:19]([CH2:20][CH2:21][CH2:22][N:23]([CH2:31][C:32]3[CH:37]=[CH:36][C:35]([CH2:38][C:39]([OH:41])=[O:40])=[CH:34][CH:33]=3)[CH:24]3[CH2:29][CH2:28][N:27]([CH3:30])[CH2:26][CH2:25]3)[C:15]=2[C:14]2[CH:13]=[CH:12][CH:11]=[CH:10][C:9]=2[N:8]=1.[CH3:46]O>>[NH2:6][C:7]1[C:16]2[N:17]=[C:18]([CH2:42][CH2:43][CH2:44][CH3:45])[N:19]([CH2:20][CH2:21][CH2:22][N:23]([CH2:31][C:32]3[CH:33]=[CH:34][C:35]([CH2:38][C:39]([O:41][CH3:46])=[O:40])=[CH:36][CH:37]=3)[CH:24]3[CH2:25][CH2:26][N:27]([CH3:30])[CH2:28][CH2:29]3)[C:15]=2[C:14]2[CH:13]=[CH:12][CH:11]=[CH:10][C:9]=2[N:8]=1