Ethanol → HCID 178520125, compound

HRID 108538Notes

Reaction equation

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

Participants

Reactant 4

HCID 702Ethanol

HCID 923Sodium ion

HCID 961Hydroxide

HCID 178527318HCID 178527318, compound

Product 1

HCID 178520125HCID 178520125, compound

Sources & evidence

ORD record: ord-e126119f7ba943de84358091c77ab9d1
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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