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Bicarbonate Ion → 2-(((3-methyl-4-(2-(2-propyl-1,3-dioxolan-2-yl)ethoxy)pyridin-2-yl)methyl)sulfinyl)-1H-benzimidazole

HRID 1135252
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HRID 1135252 반응식
[C:41](=[O:42])([O-:43])[OH:44].[CH3:1][c:2]1[c:3]([CH2:19][S:20][c:21]2[n:22][c:23]3[c:24]([nH:25]2)[cH:26][cH:27][cH:28][cH:29]3)[n:4][cH:5][cH:6][c:7]1[O:8][CH2:9][CH2:10][C:11]1([CH2:16][CH2:17][CH3:18])[O:12][CH2:13][CH2:14][O:15]1.[CH3:46][CH2:47][O:48][C:49](=[O:50])[CH3:51].[CH3:52][c:53]1[cH:54][cH:55][cH:56][cH:57][cH:58]1.[CH3:59][OH:60].[Na+:45].[OH:30][O:31][C:32]([c:33]1[cH:34][c:35]([Cl:36])[cH:37][cH:38][cH:39]1)=[O:40]>>[CH3:1][c:2]1[c:3]([CH2:19][S:20]([c:21]2[nH:22][c:23]3[c:24]([n:25]2)[cH:26][cH:27][cH:28][cH:29]3)=[O:30])[n:4][cH:5][cH:6][c:7]1[O:8][CH2:9][CH2:10][C:11]1([CH2:16][CH2:17][CH3:18])[O:12][CH2:13][CH2:14][O:15]1
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참가 물질

8

반응물 7

HCID 769Bicarbonate IonHCID 887MethanolHCID 923Sodium IonHCID 1140TolueneHCID 8857Ethyl AcetateHCID 70297m-Chloroperbenzoic acidHCID 597923962-(((3-methyl-4-(2-(2-propyl-1,3-dioxolan-2-yl)ethoxy)pyridin-2-yl)methyl)thio)-1H-benzimidazole

생성물

1
HCID 597925212-(((3-methyl-4-(2-(2-propyl-1,3-dioxolan-2-yl)ethoxy)pyridin-2-yl)methyl)sulfinyl)-1H-benzimidazole

출처 및 근거

ORD 기록
ord-1d99fd60c75c43c49ea536023a1d49da
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI
10.1039/C8SC04228D

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