Bicarbonate Ion → HCID 59507041, 화합물
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[C:36](=[O:37])([O-:38])[OH:39].[CH3:32][C:33]([Cl:34])=[O:35].[NH2:1][c:2]1[s:3][c:4]2[n:5][c:6]([NH:11][c:12]3[cH:13][c:14]([NH:18][C:19]([c:20]4[cH:21][c:22]([C:26]([CH3:27])([CH3:28])[C:29]#[N:30])[cH:23][cH:24][cH:25]4)=[O:31])[cH:15][cH:16][cH:17]3)[n:7][cH:8][c:9]2[n:10]1.[Na+:40].[cH:41]1[cH:42][cH:43][n:44][cH:45][cH:46]1>>[NH:1]([c:2]1[s:3][c:4]2[n:5][c:6]([NH:11][c:12]3[cH:13][c:14]([NH:18][C:19]([c:20]4[cH:21][c:22]([C:26]([CH3:27])([CH3:28])[C:29]#[N:30])[cH:23][cH:24][cH:25]4)=[O:31])[cH:15][cH:16][cH:17]3)[n:7][cH:8][c:9]2[n:10]1)[C:33]([CH3:32])=[O:35]참가 물질
6
출처 및 근거
- ORD 기록
- ord-a5113a57cb9b46469d65b2725f5da5f3
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)