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Hydrochloric Acid → {3-[3-(2-methoxy-phenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-phenyl}-(3-trifluoromethyl-pyridin-2-yl)-methanol

HRID 1549746
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HRID 1549746 반응식
[CH3:1][O:2][c:3]1[c:4](-[c:9]2[cH:10][n:11]([S:36]([c:37]3[cH:38][cH:39][c:40]([CH3:41])[cH:42][cH:43]3)(=[O:44])=[O:45])[c:12]3[n:13][cH:14][c:15](-[c:18]4[cH:19][c:20]([CH:24]([OH:25])[c:26]5[n:27][cH:28][cH:29][cH:30][c:31]5[C:32]([F:33])([F:34])[F:35])[cH:21][cH:22][cH:23]4)[cH:16][c:17]23)[cH:5][cH:6][cH:7][cH:8]1.[CH3:47][CH2:48][OH:49].[ClH:46].[Na+:51].[OH-:50]>>[CH3:1][O:2][c:3]1[c:4](-[c:9]2[cH:10][nH:11][c:12]3[n:13][cH:14][c:15](-[c:18]4[cH:19][c:20]([CH:24]([OH:25])[c:26]5[n:27][cH:28][cH:29][cH:30][c:31]5[C:32]([F:33])([F:34])[F:35])[cH:21][cH:22][cH:23]4)[cH:16][c:17]23)[cH:5][cH:6][cH:7][cH:8]1
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반응물 5

HCID 313Hydrochloric AcidHCID 702EthanolHCID 923Sodium IonHCID 961HydroxideHCID 59824986{3-[3-(2-methoxy-phenyl)-1-(toluene-4-sulfonyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-phenyl}-(3-trifluoromethyl-pyridin-2-yl)-methanol

생성물 1

HCID 59824848
{3-[3-(2-methoxy-phenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-phenyl}-(3-trifluoromethyl-pyridin-2-yl)-methanol

출처 및 근거

ORD 기록
ord-970dc23af4b94775925e84254f450f7e
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI
10.1039/C8SC04228D

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