Hydrochloric Acid → HCID 178497218, compound
Reaction equation
[BH3:39].[CH2:40]1[O:41][CH2:42][CH2:43][CH2:44]1.[CH2:46]1[O:47][CH2:48][CH2:49][CH2:50]1.[CH3:51][OH:52].[CH3:53][CH2:54][O:55][C:56]([CH3:57])=[O:58].[CH:1]1([c:7]2[c:8]3[cH:9][cH:10][c:11]([C:35](=[O:36])[O:37][CH3:38])[cH:12][c:13]3[n:14]3[c:15]2-[c:16]2[c:17]([cH:30][c:31]([F:34])[cH:32][cH:33]2)[CH2:18][N:19]([C:22]([CH:23]2[N:24]([CH3:28])[CH2:25][CH2:26][CH2:27]2)=[O:29])[CH2:20][CH2:21]3)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1.[ClH:45]>>[CH:1]1([c:7]2[c:8]3[cH:9][cH:10][c:11]([C:35](=[O:36])[O:37][CH3:38])[cH:12][c:13]3[n:14]3[c:15]2-[c:16]2[c:17]([cH:30][c:31]([F:34])[cH:32][cH:33]2)[CH2:18][N:19]([CH2:22][CH:23]2[N:24]([CH3:28])[CH2:25][CH2:26][CH2:27]2)[CH2:20][CH2:21]3)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1Participants
7
Sources & evidence
- ORD record
- ord-92a23dcdd71c4f23a0646a6915fffe8a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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