Ethanol → HCID 54543058, compound

HRID 2314195Notes

Reaction equation

HRID 2314195 reaction equation
[C:44](=[O:45])([O-:46])[O-:47].[CH3:33][c:34]1[cH:35][cH:36][c:37]([S:38](=[O:39])(=[O:40])[OH:41])[cH:42][cH:43]1.[CH3:50][CH2:51][OH:52].[Na+:48].[Na+:49].[n:1]1([CH:6]([c:7]2[cH:8][c:9]([CH2:19][O:20][CH:21]3[CH2:22][CH2:23][CH2:24][CH2:25][O:26]3)[c:10]([NH:13][C:14]([O:15][CH2:16][CH3:17])=[O:18])[cH:11][cH:12]2)[c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[cH:2][n:3][cH:4][cH:5]1>>[n:1]1([CH:6]([c:7]2[cH:8][c:9]([CH2:19][OH:20])[c:10]([NH:13][C:14]([O:15][CH2:16][CH3:17])=[O:18])[cH:11][cH:12]2)[c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[cH:2][n:3][cH:4][cH:5]1

Participants

6

Sources & evidence

ORD record
ord-8438efc36e6a437db50f8f8a6b924bdd
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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