Bicarbonate Ion → [3,4,5-triacetyloxy-6-[[3-[2-(4-carbamoylphenyl)ethyl]-1-benzofuran-4-yl]oxy]oxan-2-yl]methyl acetate
반응식
[B:57]([F:58])([F:59])[F:60].[C:1]([NH2:2])(=[O:3])[c:4]1[cH:5][cH:6][c:7]([CH2:10][CH2:11][c:12]2[cH:13][o:14][c:15]3[c:16]2[c:17]([OH:21])[cH:18][cH:19][cH:20]3)[cH:8][cH:9]1.[C:22]([CH3:23])(=[O:24])[O:25][CH:26]1[CH:27]([O:28][C:29](=[NH:30])[C:31]([Cl:32])([Cl:33])[Cl:34])[O:35][CH:36]([CH2:47][O:48][C:49]([CH3:50])=[O:51])[CH:37]([O:43][C:44]([CH3:45])=[O:46])[CH:38]1[O:39][C:40]([CH3:41])=[O:42].[C:61](=[O:62])([O-:63])[OH:64].[CH2:52]([O:53][CH2:54][CH3:55])[CH3:56].[Cl:66][CH2:67][Cl:68].[Na+:65]>>[C:1]([NH2:2])(=[O:3])[c:4]1[cH:5][cH:6][c:7]([CH2:10][CH2:11][c:12]2[cH:13][o:14][c:15]3[c:16]2[c:17]([O:21][CH:27]2[CH:26]([O:25][C:22]([CH3:23])=[O:24])[CH:38]([O:39][C:40]([CH3:41])=[O:42])[CH:37]([O:43][C:44]([CH3:45])=[O:46])[CH:36]([CH2:47][O:48][C:49]([CH3:50])=[O:51])[O:35]2)[cH:18][cH:19][cH:20]3)[cH:8][cH:9]1참가 물질
8
반응물 7
생성물 1
출처 및 근거
- ORD 기록
- ord-64dab71e57ab405790d2a319a9ea3678
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
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