Ethanol → HCID 66777988, compound

HRID 109522Notes

Reaction equation

HRID 109522 reaction equation
[CH3:46][CH2:47][OH:48].[CH:1]1([CH:7]([c:8]2[o:9][c:10]3[c:11]([c:12]2[CH3:13])[cH:14][c:15]([O:18][CH2:19][c:20]2[cH:21][n:22][cH:23][cH:24][cH:25]2)[cH:16][cH:17]3)[NH:26][c:27]2[cH:28][cH:29][c:30]([C:33](=[O:34])[N:35]([CH2:36][CH2:37][C:38](=[O:39])[O:40][CH2:41][CH3:42])[CH3:43])[cH:31][cH:32]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1.[Na+:45].[OH-:44]>>[CH:1]1([CH:7]([c:8]2[o:9][c:10]3[c:11]([c:12]2[CH3:13])[cH:14][c:15]([O:18][CH2:19][c:20]2[cH:21][n:22][cH:23][cH:24][cH:25]2)[cH:16][cH:17]3)[NH:26][c:27]2[cH:28][cH:29][c:30]([C:33](=[O:34])[N:35]([CH2:36][CH2:37][C:38](=[O:39])[OH:40])[CH3:43])[cH:31][cH:32]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1

Participants

5

Sources & evidence

ORD record
ord-c1a335ecac7045a3bb01fd78ebeb028e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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