Ethanol → HCID 19348658, compound

HRID 166580Notes

Reaction equation

HRID 166580 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[c:6]([NH:14][C:15]([CH2:16][CH:17]([CH2:18][CH2:19][CH2:20][CH2:21][CH3:22])[c:23]2[c:24]([O:37][CH3:38])[cH:25][c:26]([O:29][CH2:30][c:31]3[cH:32][cH:33][cH:34][cH:35][cH:36]3)[cH:27][cH:28]2)=[O:39])[cH:7][c:8]([C:11]([NH2:12])=[O:13])[cH:9][cH:10]1.[CH3:42][CH2:43][OH:44].[H:40][H:41]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[c:6]([NH:14][C:15]([CH2:16][CH:17]([CH2:18][CH2:19][CH2:20][CH2:21][CH3:22])[c:23]2[c:24]([O:37][CH3:38])[cH:25][c:26]([OH:29])[cH:27][cH:28]2)=[O:39])[cH:7][c:8]([C:11]([NH2:12])=[O:13])[cH:9][cH:10]1

Participants

4

Sources & evidence

ORD record
ord-dc80f60ac37c4eaabec47bdf9d3533e0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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