HRID2230227

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6422

未命名化合物

结构：COc1ccc([C@@H](N)CC(=O)OC(C)(C)C)c(OC)c1

HCID53676007

未命名化合物

结构：CC(C)C[C@@H](C(=O)[O-])N1C(=O)N(Cc2ccccc2)[C@@](C)(c2ccccc2)C1=O

HCID131723411

未命名化合物

PRODUCTS

生成物

结构：COc1ccc([C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)N2C(=O)N(Cc3ccccc3)[C@@](C)(c3ccccc3)C2=O)c(OC)c1

HCID59902382

未命名化合物

PROCEDURE

实验过程

(by reaction of 169.5 with tert-butyl (S)-3-amino-3-(2,4-dimethoxyphenyl)propionate and subsequent cleavage of the tert-butyl ester with trifluoroacetic acid)

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0dc233e0b577407da6194b8ead07048b
来源数据集: uspto-grants-2002_07
DOI: 10.6084/m9.figshare.5104873.v1
专利: US06423712B1
来源说明: uspto-grants-2002_07

反应 SMILES

[C:1]1([C@@:7]2([CH3:29])[C:11](=[O:12])[N:10]([C@@H:13]([CH2:17][CH:18]([CH3:20])[CH3:19])[C:14]([O-])=[O:15])[C:9](=[O:21])[N:8]2[CH2:22][C:23]2[CH:28]=[CH:27][CH:26]=[CH:25][CH:24]=2)[CH:6]=[CH:5][CH:4]=[CH:3][CH:2]=1.[NH2:30][C@H:31]([C:40]1[CH:45]=[CH:44][C:43]([O:46][CH3:47])=[CH:42][C:41]=1[O:48][CH3:49])[CH2:32][C:33]([O:35]C(C)(C)C)=[O:34].FC(F)(F)C(O)=O>>[C:1]1([C@@:7]2([CH3:29])[C:11](=[O:12])[N:10]([C@@H:13]([CH2:17][CH:18]([CH3:19])[CH3:20])[C:14]([NH:30][C@H:31]([C:40]3[CH:45]=[CH:44][C:43]([O:46][CH3:47])=[CH:42][C:41]=3[O:48][CH3:49])[CH2:32][C:33]([OH:35])=[O:34])=[O:15])[C:9](=[O:21])[N:8]2[CH2:22][C:23]2[CH:28]=[CH:27][CH:26]=[CH:25][CH:24]=2)[CH:6]=[CH:5][CH:4]=[CH:3][CH:2]=1