Isopropanol → HCID 178491413, compound
Reaction equation
[C:8]([NH:9][c:17]1[n:18][c:19](=[O:54])[n:20]([CH:21]2[CH2:22][CH:23]([OH:24])[CH:25]([CH2:26][O:27][C:28]([c:29]3[cH:30][cH:31][c:32]([O:35][CH3:36])[cH:33][cH:34]3)([c:37]3[cH:38][cH:39][c:40]([O:43][CH3:44])[cH:41][cH:42]3)[c:45]3[cH:46][cH:47][cH:48][cH:49][cH:50]3)[O:51]2)[cH:52][cH:53]1)(=[O:10])[c:11]1[cH:12][cH:13][cH:14][cH:15][cH:16]1.[CH3:65][CH:66]([OH:67])[CH3:68].[N:55]12[CH2:56][CH2:57][CH2:58][NH:59][C:60]1=[N:61][CH2:62][CH2:63][CH2:64]2.[NH2:1][CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][OH:7]>>[NH:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][OH:7])[c:17]1[n:18][c:19](=[O:54])[n:20]([CH:21]2[CH2:22][CH:23]([OH:24])[CH:25]([CH2:26][O:27][C:28]([c:29]3[cH:30][cH:31][c:32]([O:35][CH3:36])[cH:33][cH:34]3)([c:37]3[cH:38][cH:39][c:40]([O:43][CH3:44])[cH:41][cH:42]3)[c:45]3[cH:46][cH:47][cH:48][cH:49][cH:50]3)[O:51]2)[cH:52][cH:53]1Participants
5
Sources & evidence
- ORD record
- ord-a3f0b96aba064f569e210a6b36aa7979
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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