Water → HCID 19900723, compound

HRID 318091Notes

Reaction equation

HRID 318091 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[n:8]1[c:9]([CH:25]=[O:26])[n:10][c:11](-[c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)[c:12]1-[c:13]1[cH:14][cH:15][cH:16][cH:17][cH:18]1.[CH3:50][c:51]1[cH:52][cH:53][cH:54][cH:55][cH:56]1.[CH3:57][CH2:58][CH2:59][CH2:60][CH2:61][CH3:62].[CH3:63][CH2:64][O:65][C:66](=[O:67])[CH3:68].[OH2:49].[OH:27][CH2:28][CH2:29][CH2:30][OH:31].[c:32]1([CH3:33])[cH:34][cH:35][c:36]([S:37]([O-:38])(=[O:39])=[O:40])[cH:41][cH:42]1.[nH+:43]1[cH:44][cH:45][cH:46][cH:47][cH:48]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[n:8]1[c:9]([CH:25]2[O:26][CH2:30][CH2:29][CH2:28][O:27]2)[n:10][c:11](-[c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)[c:12]1-[c:13]1[cH:14][cH:15][cH:16][cH:17][cH:18]1

Participants

9

Reactant 8

HCID 962WaterHCID 1140TolueneHCID 8058HexaneHCID 8857Ethyl AcetateHCID 104421,3-PropanediolHCID 85570p-ToluenesulfonateHCID 4989215PyridiniumHCID 19900725HCID 19900725, compound

Product 1

HCID 19900723HCID 19900723, compound

Sources & evidence

ORD record
ord-722b580f8a9048e497d19a5349ebe2b8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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