Hydrochloric Acid → HCID 11505170, 화합물

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[CH3:1][C:2]([CH2:3][O:4][c:5]1[c:6]([C:7](=[O:8])[OH:9])[cH:10][c:11]([S:14](=[O:15])(=[O:16])[CH3:17])[cH:12][cH:13]1)([CH3:18])[CH3:19].[ClH:20].[c:21]1([S:27](=[O:28])(=[O:29])[c:30]2[cH:31][n:32][c:33]([N:35]3[CH2:36][CH2:37][NH:38][CH2:39][CH2:40]3)[s:34]2)[cH:22][cH:23][cH:24][cH:25][cH:26]1>>[CH3:1][C:2]([CH2:3][O:4][c:5]1[c:6]([C:7](=[O:9])[N:38]2[CH2:37][CH2:36][N:35]([c:33]3[n:32][cH:31][c:30]([S:27]([c:21]4[cH:22][cH:23][cH:24][cH:25][cH:26]4)(=[O:28])=[O:29])[s:34]3)[CH2:40][CH2:39]2)[cH:10][c:11]([S:14](=[O:15])(=[O:16])[CH3:17])[cH:12][cH:13]1)([CH3:18])[CH3:19]

참가 물질

반응물 3

HCID 313Hydrochloric Acid

HCID 211002032-(2,2-Dimethyl-propoxy)-5-methanesulfonyl-benzoic acid

HCID 67549228HCID 67549228, 화합물

생성물 1

HCID 11505170HCID 11505170, 화합물

출처 및 근거

ORD 기록: ord-7fe1eb6b6c19449e85805670ee628a26
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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