Ethanol → HCID 19709473, compound
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[CH2:11][c:12]1[cH:13][c:14]([NH:18][C:19]([NH:20][CH2:21][C:22](=[O:23])[N:24]2[CH:25]([C:45](=[O:46])[N:47]3[CH2:48][CH2:49][CH2:50][c:51]4[cH:52][cH:53][cH:54][cH:55][c:56]43)[CH2:26][CH:27]([S:36](=[O:37])(=[O:38])[c:39]3[cH:40][cH:41][cH:42][cH:43][cH:44]3)[CH:28]2[c:29]2[c:30]([F:35])[cH:31][cH:32][cH:33][cH:34]2)=[O:57])[cH:15][cH:16][cH:17]1.[CH3:58][CH2:59][OH:60]>>[O:8]=[C:9]([OH:10])[CH2:11][c:12]1[cH:13][c:14]([NH:18][C:19]([NH:20][CH2:21][C:22](=[O:23])[N:24]2[CH:25]([C:45](=[O:46])[N:47]3[CH2:48][CH2:49][CH2:50][c:51]4[cH:52][cH:53][cH:54][cH:55][c:56]43)[CH2:26][CH:27]([S:36](=[O:37])(=[O:38])[c:39]3[cH:40][cH:41][cH:42][cH:43][cH:44]3)[CH:28]2[c:29]2[c:30]([F:35])[cH:31][cH:32][cH:33][cH:34]2)=[O:57])[cH:15][cH:16][cH:17]1Participants
3
Sources & evidence
- ORD record
- ord-06713ed596104e52926da1978d392749
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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