1-(5-fluoro-benzo[b]thiophen-3-ylmethyl)-3-(methoxycarbonylamino-methyl)-1H-indole-2-carboxylic acid ethyl ester → 1-(5-Fluoro-benzo[b]thiophen-3-ylmethyl)-3-(methoxycarbonylamino-methyl)-1H-indole-2-carboxylic acid
반응식
[CH2:1]([O:2][C:3]([c:4]1[n:5]([CH2:6][c:7]2[c:8]3[cH:9][c:10]([F:11])[cH:12][cH:13][c:14]3[s:15][cH:16]2)[c:17]2[c:18]([c:19]1[CH:20]=[O:21])[cH:22][cH:23][cH:24][cH:25]2)=[O:26])[CH3:27].[CH2:28]([CH3:29])[O:30][C:31](=[O:32])[c:33]1[n:34]([CH2:48][c:49]2[c:50]3[c:51]([s:52][cH:53]2)[cH:54][cH:55][c:56]([F:58])[cH:57]3)[c:35]2[cH:36][cH:37][cH:38][cH:39][c:40]2[c:41]1[CH2:42][NH:43][C:44](=[O:45])[O:46][CH3:47]>>[O:30]=[C:31]([OH:32])[c:33]1[n:34]([CH2:48][c:49]2[c:50]3[c:51]([s:52][cH:53]2)[cH:54][cH:55][c:56]([F:58])[cH:57]3)[c:35]2[cH:36][cH:37][cH:38][cH:39][c:40]2[c:41]1[CH2:42][NH:43][C:44](=[O:45])[O:46][CH3:47]참가 물질
3
반응물 2
생성물 1
출처 및 근거
- ORD 기록
- ord-307fbf037b254f8fb76f7525e980cbb0
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)