Toluene → HCID 178492553, 화합물
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[C:29](=[O:30])([O-:31])[O-:32].[CH3:35][O:36][CH2:37][CH2:38][O:39][CH2:40][CH2:41][O:42][CH3:43].[CH3:44][CH2:45][O:46][C:47]([CH3:48])=[O:49].[CH3:52][c:53]1[cH:54][cH:55][cH:56][cH:57][cH:58]1.[Cs+:33].[Cs+:34].[Cu:50][I:51].[I:1][c:2]1[c:3]([O:10][CH3:11])[cH:4][c:5]([O:8][CH3:9])[cH:6][cH:7]1.[OH:12][CH2:13][CH:14]1[C:15]([OH:27])([CH3:28])[CH2:16][CH2:17][CH:18]2[C:19]([CH3:25])([CH3:26])[CH2:20][CH2:21][CH2:22][C:23]12[CH3:24]>>[c:2]1([O:12][CH2:13][CH:14]2[C:15]([OH:27])([CH3:28])[CH2:16][CH2:17][CH:18]3[C:19]([CH3:25])([CH3:26])[CH2:20][CH2:21][CH2:22][C:23]23[CH3:24])[c:3]([O:10][CH3:11])[cH:4][c:5]([O:8][CH3:9])[cH:6][cH:7]1참가 물질
9
반응물 8
생성물 1
출처 및 근거
- ORD 기록
- ord-c1c1ddc23162407bb1ffbe10c0722be8
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
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