HRID632574

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID7022311

未命名化合物

结构：C=C(C)c1cc(C(=O)N2Cc3ccc(CC=O)cc3C2)c(OCc2ccccc2)cc1OCc1ccccc1

HCID86686424

未命名化合物

PRODUCTS

生成物

结构：CC(C)C[C@H](NCCc1ccc2c(c1)CN(C(=O)c1cc(C(C)C)c(O)cc1O)C2)C(=O)OC(C)(C)C

HCID54767461

未命名化合物

PROCEDURE

实验过程

Prepared from Intermediate F and L-leucine tert-butyl ester. 1H NMR (300 MHz, d3-MeOD) 7.31-7.12 (4H, m), 6.38 (1H, s), 3.24-3.04 (2H, m), 2.90-2.69 (4H, m), 1.76-1.56 (1H, m), 1.45 (9H, s), 1.23 (6H, d, J=7.0 Hz), 0.93 (6H, dd, J=10.9, 6.6 Hz). LC/MS: purity >98%, m/z 511 [M+H]+

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ef8cd165b2444f7aa5ad595274aa61a5
来源数据集: uspto-grants-2016_04
DOI: 10.6084/m9.figshare.5104873.v1
专利: US09321718B2
来源说明: uspto-grants-2016_04

反应 SMILES

C([O:8][C:9]1[CH:14]=[C:13]([O:15]CC2C=CC=CC=2)[C:12]([C:23]([CH3:25])=[CH2:24])=[CH:11][C:10]=1[C:26]([N:28]1[CH2:36][C:35]2[C:30](=[CH:31][CH:32]=[C:33]([CH2:37][CH:38]=O)[CH:34]=2)[CH2:29]1)=[O:27])C1C=CC=CC=1.[C:40]([O:44][C:45](=[O:52])[C@H:46]([CH2:48][CH:49]([CH3:51])[CH3:50])[NH2:47])([CH3:43])([CH3:42])[CH3:41]>>[OH:8][C:9]1[CH:14]=[C:13]([OH:15])[C:12]([CH:23]([CH3:24])[CH3:25])=[CH:11][C:10]=1[C:26]([N:28]1[CH2:36][C:35]2[C:30](=[CH:31][CH:32]=[C:33]([CH2:37][CH2:38][NH:47][C@H:46]([C:45]([O:44][C:40]([CH3:43])([CH3:42])[CH3:41])=[O:52])[CH2:48][CH:49]([CH3:50])[CH3:51])[CH:34]=2)[CH2:29]1)=[O:27]