HRID879209

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：CCO[C@H]1[C@@H](C)CC(c2ccncc2[N+](=O)[O-])=C[C@H]1NC(=O)OC(C)(C)C

HCID86705257

未命名化合物

PRODUCTS

生成物

结构：CCO[C@@H]1[C@H](C)C[C@H](c2ccncc2N)C[C@@H]1NC(=O)OC(C)(C)C

HCID86705258

未命名化合物

收率 33%

HCID86705259

未命名化合物

收率 28%

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID22502148

未命名化合物

PROCEDURE

实验过程

Method 6 was followed using (+/−)-tert-butyl (1R,5S,6S)-6-ethoxy-5-methyl-3-(3-nitropyridin-4-yl)cyclohex-2-enylcarbamate with Chiral HPLC (Heptane/EtOH=90/10, 20 mL/min, IC column) to yield tert-butyl ((1S,2R,3R,5S)-5-(3-aminopyridin-4-yl)-2-ethoxy-3-methylcyclohexyl)carbamate (33% yield, 99% ee) and tert-butyl ((1R,2S,3S,5R)-5-(3-aminopyridin-4-yl)-2-ethoxy-3-methylcyclohexyl)carbamate (28% yield, 99% ee). LC/MS (m/z)=350.2 (MH+), Rt=0.72 min.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-762e7b8dc9234317ac314f4ae9d92262
来源数据集: uspto-grants-2015_03
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08987457B2
来源说明: uspto-grants-2015_03

反应 SMILES

[CH2:1]([O:3][C@@H:4]1[C@H:9]([NH:10][C:11](=[O:17])[O:12][C:13]([CH3:16])([CH3:15])[CH3:14])[CH:8]=[C:7]([C:18]2[CH:23]=[CH:22][N:21]=[CH:20][C:19]=2[N+:24]([O-])=O)[CH2:6][C@@H:5]1[CH3:27])[CH3:2]>CCCCCCC.CCO>[NH2:24][C:19]1[CH:20]=[N:21][CH:22]=[CH:23][C:18]=1[C@@H:7]1[CH2:8][C@H:9]([NH:10][C:11](=[O:17])[O:12][C:13]([CH3:14])([CH3:15])[CH3:16])[C@H:4]([O:3][CH2:1][CH3:2])[C@H:5]([CH3:27])[CH2:6]1.[NH2:24][C:19]1[CH:20]=[N:21][CH:22]=[CH:23][C:18]=1[C@H:7]1[CH2:8][C@@H:9]([NH:10][C:11](=[O:17])[O:12][C:13]([CH3:14])([CH3:15])[CH3:16])[C@@H:4]([O:3][CH2:1][CH3:2])[C@@H:5]([CH3:27])[CH2:6]1