Hydrochloric Acid → 8-Chloro-6-ethoxycarbonyl-5-methylthiochroman-4-ol
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[BH4-:19].[CH3:22][CH2:23][OH:24].[Cl:1][c:2]1[cH:3][c:4]([C:14](=[O:15])[O:16][CH2:17][CH3:18])[c:5]([CH3:13])[c:6]2[c:11]1[S:10][CH2:9][CH2:8][C:7]2=[O:12].[Cl:25][CH2:26][Cl:27].[ClH:21].[Na+:20]>>[Cl:1][c:2]1[cH:3][c:4]([C:14](=[O:15])[O:16][CH2:17][CH3:18])[c:5]([CH3:13])[c:6]2[c:11]1[S:10][CH2:9][CH2:8][CH:7]2[OH:12]참가 물질
7
출처 및 근거
- ORD 기록
- ord-63a9d57c805044c086219672ce65cd65
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
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