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Hydrochloric Acid → 2-(6-(4-(4-Chlorophenethylcarbamoyl)phenoxy)-4'-(methylsulfonyl)biphenyl-3-yl)acetic acid

HRID 690921
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HRID 690921 반응식
[CH3:51][CH2:52][O:53][C:54](=[O:55])[CH3:56].[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][CH2:7][NH:8][C:9](=[O:10])[c:11]2[cH:12][cH:13][c:14]([O:15][c:16]3[cH:17][cH:18][c:19]([CH2:32][C:33](=[O:34])[O:35][CH2:36][CH3:37])[cH:20][c:21]3-[c:22]3[cH:23][cH:24][c:25]([S:28](=[O:29])(=[O:30])[CH3:31])[cH:26][cH:27]3)[cH:38][cH:39]2)[cH:40][cH:41]1.[ClH:57].[Na+:43].[O:45]1[CH2:46][CH2:47][O:48][CH2:49][CH2:50]1.[OH-:42].[OH2:44]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][CH2:7][NH:8][C:9](=[O:10])[c:11]2[cH:12][cH:13][c:14]([O:15][c:16]3[cH:17][cH:18][c:19]([CH2:32][C:33](=[O:34])[OH:35])[cH:20][c:21]3-[c:22]3[cH:23][cH:24][c:25]([S:28](=[O:29])(=[O:30])[CH3:31])[cH:26][cH:27]3)[cH:38][cH:39]2)[cH:40][cH:41]1
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반응물 7

HCID 313Hydrochloric AcidHCID 923Sodium IonHCID 961HydroxideHCID 962WaterHCID 8857Ethyl AcetateHCID 312751,4-DioxaneHCID 68467112Ethyl 2-(6-(4-(4-chlorophenethylcarbamoyl)phenoxy)-4'-(methylsulfonyl)biphenyl-3-yl)acetate

생성물 1

HCID 594031712-(6-(4-(4-Chlorophenethylcarbamoyl)phenoxy)-4'-(methylsulfonyl)biphenyl-3-yl)acetic acid

출처 및 근거

ORD 기록
ord-af457936e4294255a2755bb2c2aca2aa
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI
10.1039/C8SC04228D

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