Hydrochloric Acid → (3-{5-[5-Cyano-1-(2,4-difluoro-benzyl)-6-oxo-4-trifluoromethyl-1,6-dihydro-pyridin-2-yl]-thiophen-3-yl}-phenyl)-acetic acid

HRID 188294노트

반응식

HRID 188294 반응식
[CH2:39]1[O:40][CH2:41][CH2:42][CH2:43]1.[CH3:1][O:2][C:3]([CH2:4][c:5]1[cH:6][c:7](-[c:11]2[cH:12][s:13][c:14](-[c:16]3[n:17]([CH2:29][c:30]4[c:31]([F:37])[cH:32][c:33]([F:36])[cH:34][cH:35]4)[c:18](=[O:28])[c:19]([C:26]#[N:27])[c:20]([C:22]([F:23])([F:24])[F:25])[cH:21]3)[cH:15]2)[cH:8][cH:9][cH:10]1)=[O:38].[ClH:47].[Li+:45].[OH-:44].[OH2:46].[OH2:48]>>[O:2]=[C:3]([CH2:4][c:5]1[cH:6][c:7](-[c:11]2[cH:12][s:13][c:14](-[c:16]3[n:17]([CH2:29][c:30]4[c:31]([F:37])[cH:32][c:33]([F:36])[cH:34][cH:35]4)[c:18](=[O:28])[c:19]([C:26]#[N:27])[c:20]([C:22]([F:23])([F:24])[F:25])[cH:21]3)[cH:15]2)[cH:8][cH:9][cH:10]1)[OH:38]

참가 물질

7

출처 및 근거

ORD 기록
ord-29b1fae20fda492babfd7b12103212b5
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

반응 노트

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