HRID91760

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID66620210

[1-(2-{5-[6-(4-{2-[1-(2-Methoxycarbonylamino-3-methyl-butyryl)-pyrrolidin-2-yl]-3H-imidazol-4-yl}-phenyl)-naphthalen-2-yl}-1H-imidazol-2-yl]-pyrrolidine-1-carbonyl)-2-methyl-propyl]-carbamic acid methyl ester

C44H52N8O6

HCID66620765

未命名化合物

PRODUCTS

产物

HCID66620814

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-ac59ecaf90684818b9a45be2b9b25289
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应SMILES

[CH3:1][O:2][C:3]([NH:4][CH:5]([CH:6]([CH3:7])[CH3:8])[C:9](=[O:10])[N:11]1[CH:12]([c:16]2[nH:17][c:18](-[c:21]3[cH:22][c:23]4[cH:24][cH:25][c:26](-[c:31]5[cH:32][cH:33][c:34](-[c:37]6[nH:38][c:39]([CH:42]7[N:43]([C:47]([CH:48]([CH:49]([CH3:50])[CH3:51])[NH:52][C:53](=[O:54])[O:55][CH3:56])=[O:57])[CH2:44][CH2:45][CH2:46]7)[n:40][cH:41]6)[cH:35][cH:36]5)[cH:27][c:28]4[cH:29][cH:30]3)[cH:19][n:20]2)[CH2:13][CH2:14][CH2:15]1)=[O:58].[CH3:59][O:60][C:61]([NH:62][CH:64]([C:65]([N:66]1[CH2:67][CH2:68][CH2:69][CH:70]1[c:71]1[nH:72][c:73](-[c:74]2[cH:75][cH:76][c:77]3[c:78]([cH:79][cH:80][c:81]([B:82]4[O:83][C:84]([CH3:85])([CH3:86])[C:87]([CH3:88])([CH3:89])[O:90]4)[cH:91]3)[cH:92]2)[cH:93][n:94]1)=[O:95])[CH:96]([CH3:97])[CH3:98])=[O:63]>>[CH3:1][O:2][C:3]([NH:4][CH:5]([CH:6]([CH3:7])[CH3:8])[C:9](=[O:10])[N:11]1[CH:12]([c:16]2[nH:17][c:18](-[c:21]3[cH:22][c:23]4[cH:24][cH:25][c:26](-[c:31]5[cH:32][cH:33][c:34](-[c:37]6[nH:38][c:39]([CH:42]7[N:43]([C:47]([CH:48]([CH:49]([CH3:50])[CH3:51])[NH:52][C:53](=[O:54])[O:55][CH3:56])=[O:57])[CH2:44][CH:45]([C:61]#[N:62])[CH2:46]7)[n:40][cH:41]6)[cH:35][cH:36]5)[cH:27][c:28]4[cH:29][cH:30]3)[cH:19][n:20]2)[CH2:13][CH2:14][CH2:15]1)=[O:58]