Ethanol → HCID 53241506, compound

HRID 681537Notes

Reaction equation

HRID 681537 reaction equation
[BH4-:50].[CH2:52]1[O:53][CH2:54][CH2:55][CH2:56]1.[CH3:47][CH2:48][OH:49].[CH:1]1([c:4]2[cH:5][cH:6][c:7]3[c:8]([cH:46]2)[NH:9][CH2:10][CH2:11][N:12]([c:15]2[c:16]([CH:17]=[O:18])[c:19](-[c:23]4[cH:24][n:25]([CH3:45])[c:26](=[O:44])[c:27]([NH:29][c:30]5[n:31][cH:32][c:33]([C:36](=[O:37])[N:38]6[CH2:39][CH2:40][O:41][CH2:42][CH2:43]6)[cH:34][cH:35]5)[cH:28]4)[cH:20][cH:21][cH:22]2)[C:13]3=[O:14])[CH2:2][CH2:3]1.[Na+:51]>>[CH:1]1([c:4]2[cH:5][cH:6][c:7]3[c:8]([cH:46]2)[NH:9][CH2:10][CH2:11][N:12]([c:15]2[c:16]([CH2:17][OH:18])[c:19](-[c:23]4[cH:24][n:25]([CH3:45])[c:26](=[O:44])[c:27]([NH:29][c:30]5[n:31][cH:32][c:33]([C:36](=[O:37])[N:38]6[CH2:39][CH2:40][O:41][CH2:42][CH2:43]6)[cH:34][cH:35]5)[cH:28]4)[cH:20][cH:21][cH:22]2)[C:13]3=[O:14])[CH2:2][CH2:3]1

Participants

6

Sources & evidence

ORD record
ord-1e671fafef5e48058286cee97db4ec23
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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